SCHEMBL20918138

SCHEMBL20918138

COc1ccc2c(=O)c(C(=O)O)c(-c3cccc(F)c3)oc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.56
▸ KDM4E B2RXH2 8/20 0.56
▸ HPGD P15428 7/20 0.56
▸ CYP3A4 P08684 6/20 0.56
▸ MEN1 O00255 5/20 0.56
▸ MAPT P10636 5/20 0.56
▸ KMT2A Q03164 5/20 0.56
▸ HSD17B10 Q99714 4/20 0.56
▸ THRB P10828 1/20 0.56
▸ ANO1 Q5XXA6 3/20 0.52
▸ TP53 P04637 3/20 0.51
▸ CASP1 P29466 1/20 0.51
▸ CASP7 P55210 1/20 0.51
▸ CYP2C9 P11712 3/20 0.50
▸ CYP2C19 P33261 3/20 0.50
▸ CYP1A2 P05177 2/20 0.50
▸ ADORA3 P0DMS8 1/20 0.50
▸ ABCG2 Q9UNQ0 2/20 0.49
▸ CA1 P00915 2/20 0.49
▸ CA2 P00918 2/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31723125 1.00 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDCYP3A4MEN1
SCHEMBL28430712 0.88 ALDH1A1 (0.57) ALDH1A1KDM4EHPGDCYP3A4MEN1
SCHEMBL31723148 0.88 ALDH1A1 (0.57) ALDH1A1KDM4EHPGDCYP3A4MEN1
SCHEMBL31723167 0.85 MAPT (0.62) ALDH1A1KDM4EHPGDCYP3A4MEN1
SCHEMBL28427603 0.85 MAPT (0.62) ALDH1A1KDM4EHPGDCYP3A4MEN1
SCHEMBL31723151 0.83 TTR (0.49) ALDH1A1KDM4EHPGDCYP3A4MEN1
SCHEMBL22284777 0.83 TTR (0.49) ALDH1A1KDM4EHPGDCYP3A4MEN1
SCHEMBL20918216 0.82 KMT2A (0.57) ALDH1A1KDM4EHPGDCYP3A4MEN1
SCHEMBL31723120 0.82 KMT2A (0.57) ALDH1A1KDM4EHPGDCYP3A4MEN1
SCHEMBL31723172 0.82 ABCG2 (0.73) ALDH1A1KDM4EHPGDCYP3A4MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3699174-B1 COMPOSITION FOR PREVENTING OR TREATING TNF-RELATED DISEASES, CONTAINING DERIVATIVE AS ACTIVE INGREDIENT, AND METHOD FOR INHIBITING TNF ACTIVITY BY USING SAME ILAB (KR) 2025-11-12 — — EP claimed
US-11850230-B2 Composition for preventing or treating TNF-related diseases, containing novel derivative as active ingredient, and method for inhibiting TNF activity by using same ILAB (KR) 2023-12-26 — — US claimed
US-20230099574-A1 COMPOSITION FOR PREVENTING OR TREATING TNF-RELATED DISEASES, CONTAINING NOVEL DERIVATIVE AS ACTIVE INGREDIENT, AND METHOD FOR INHIBITING TNF ACTIVITY BY USING SAME ILAB (KR) 2023-03-30 — — US claimed
US-11504349-B2 Composition for preventing or treating TNF-related diseases, containing novel derivative as active ingredient, and method for inhibiting TNF activity by using same ILAB (KR) 2022-11-22 — — US claimed
EP-3699174-A1 COMPOSITION FOR PREVENTING OR TREATING TNF-RELATED DISEASES, CONTAINING NOVEL DERIVATIVE AS ACTIVE INGREDIENT, AND METHOD FOR INHIBITING TNF ACTIVITY BY USING SAME ILAB (KR) 2020-08-26 — — EP claimed
US-20200246304-A1 Composition For Preventing Or Treating TNF-Related Diseases, Containing Novel Derivative As Active Ingredient, And Method For Inhibiting TNF Activity By Using Same ILAB (KR) 2020-08-06 — — US claimed
CN-111315730-A Composition for preventing or treating tumor necrosis factor-related diseases comprising novel derivative as active ingredient and method for inhibiting tumor necrosis factor activity using the same 艾伊莱布 2020-06-19 — — CN claimed
WO-2019078452-A1 COMPOSITION FOR PREVENTING OR TREATING TNF-RELATED DISEASES, CONTAINING NOVEL DERIVATIVE AS ACTIVE INGREDIENT, AND METHOD FOR INHIBITING TNF ACTIVITY BY USING SAME 가톨릭대학교 산학협력단 2019-04-25 — — WO claimed
EP-3699174-B1 COMPOSITION FOR PREVENTING OR TREATING TNF-RELATED DISEASES, CONTAINING DERIVATIVE AS ACTIVE INGREDIENT, AND METHOD FOR INHIBITING TNF ACTIVITY BY USING SAME ILAB (KR) 2025-11-12 — — EP disclosed
US-11850230-B2 Composition for preventing or treating TNF-related diseases, containing novel derivative as active ingredient, and method for inhibiting TNF activity by using same ILAB (KR) 2023-12-26 — — US disclosed
US-20230099574-A1 COMPOSITION FOR PREVENTING OR TREATING TNF-RELATED DISEASES, CONTAINING NOVEL DERIVATIVE AS ACTIVE INGREDIENT, AND METHOD FOR INHIBITING TNF ACTIVITY BY USING SAME ILAB (KR) 2023-03-30 — — US disclosed
US-11504349-B2 Composition for preventing or treating TNF-related diseases, containing novel derivative as active ingredient, and method for inhibiting TNF activity by using same ILAB (KR) 2022-11-22 — — US disclosed
EP-3699174-A1 COMPOSITION FOR PREVENTING OR TREATING TNF-RELATED DISEASES, CONTAINING NOVEL DERIVATIVE AS ACTIVE INGREDIENT, AND METHOD FOR INHIBITING TNF ACTIVITY BY USING SAME ILAB (KR) 2020-08-26 — — EP disclosed
US-20200246304-A1 Composition For Preventing Or Treating TNF-Related Diseases, Containing Novel Derivative As Active Ingredient, And Method For Inhibiting TNF Activity By Using Same ILAB (KR) 2020-08-06 — — US disclosed
CN-111315730-A Composition for preventing or treating tumor necrosis factor-related diseases comprising novel derivative as active ingredient and method for inhibiting tumor necrosis factor activity using the same 艾伊莱布 2020-06-19 — — CN disclosed
WO-2019078452-A1 COMPOSITION FOR PREVENTING OR TREATING TNF-RELATED DISEASES, CONTAINING NOVEL DERIVATIVE AS ACTIVE INGREDIENT, AND METHOD FOR INHIBITING TNF ACTIVITY BY USING SAME 가톨릭대학교 산학협력단 2019-04-25 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11850230-B2 Composition for preventing or treating TNF-related diseases, containing novel derivative as active ingredient, and method for inhibiting TNF activity by using same TNF, NFKBIA, TRAF6 ALDH1A1 2334/4885KDM4E 2226/4885HPGD 467/4885
US-20230099574-A1 COMPOSITION FOR PREVENTING OR TREATING TNF-RELATED DISEASES, CONTAINING NOVEL DERIVATIVE AS ACTIVE INGREDIENT, AND METHOD FOR INHIBITING TNF ACTIVITY BY USING SAME TNF, NFKBIA, TRAF6 ALDH1A1 2334/4885KDM4E 2226/4885HPGD 467/4885
US-20200246304-A1 Composition For Preventing Or Treating TNF-Related Diseases, Containing Novel Derivative As Active Ingredient, And Method For Inhibiting TNF Activity By Using Same TNF, NFKBIA, TRAF6 ALDH1A1 2334/4885KDM4E 2226/4885HPGD 467/4885
US-11504349-B2 Composition for preventing or treating TNF-related diseases, containing novel derivative as active ingredient, and method for inhibiting TNF activity by using same TNF, NFKBIA, TRAF6 ALDH1A1 2334/4885KDM4E 2226/4885HPGD 467/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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