SCHEMBL23710988

SCHEMBL23710988

CCOC(=O)c1c(NC(=S)Nc2ccccc2OC)sc2c1CC(C)(C)OC2

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 12/20 0.64
▸ MAPT P10636 5/20 0.64
▸ KMT2A Q03164 5/20 0.64
▸ HPGD P15428 4/20 0.64
▸ MEN1 O00255 4/20 0.64
▸ GAA P10253 3/20 0.64
▸ HTT P42858 1/20 0.64
▸ LMNA P02545 4/20 0.61
▸ KDM4E B2RXH2 4/20 0.61
▸ TDP1 Q9NUW8 2/20 0.61
▸ NPSR1 Q6W5P4 1/20 0.61
▸ TSHR P16473 1/20 0.61
▸ CASP1 P29466 1/20 0.61
▸ HSD17B10 Q99714 1/20 0.61
▸ L3MBTL1 Q9Y468 1/20 0.61
▸ RAB7A P51149 3/20 0.61
▸ SMN1; SMN2 Q16637 3/20 0.56
▸ PLA2G1B P04054 1/20 0.53
▸ CDC42 P60953 1/20 0.53
▸ RAB2A P61019 1/20 0.53

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
SCHEMBL14096464 0.82 RAB7A (0.78) ALDH1A1MAPTKMT2AHPGDMEN1
SCHEMBL15272485 0.78 KDM4E (0.72) ALDH1A1MAPTKMT2AHPGDMEN1
SCHEMBL15272139 0.78 ALDH1A1 (0.84) ALDH1A1MAPTKMT2AHPGDMEN1
SCHEMBL13438095 0.77 ALDH1A1 (0.84) ALDH1A1MAPTKMT2AHPGDMEN1
SCHEMBL15832860 0.75 RAB7A (0.84) ALDH1A1MAPTKMT2AMEN1GAA
SCHEMBL15273119 0.74 ALDH1A1 (0.69) ALDH1A1MAPTKMT2AHPGDMEN1
SCHEMBL15832892 0.74 CXCR2 (0.70) ALDH1A1MAPTKMT2AHPGDMEN1
SCHEMBL15832879 0.74 RAB7A (0.76) ALDH1A1MAPTKMT2AMEN1GAA
SCHEMBL3489776 0.72 ALDH1A1 (0.64) ALDH1A1MAPTKMT2AHPGDMEN1
SCHEMBL13438087 0.71 ALDH1A1 (0.74) ALDH1A1MAPTKMT2AHPGDMEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230132397-A9 USE OF TOLL-LIKE RECEPTOR 2 (TLR-2) AGONIST FOR MODULATING HUMAN IMMUNE RESPONSE CHILDREN'S MEDICAL CENTER CORPORATION (US) 2023-04-27 — — US disclosed
US-20230132397-A9 USE OF TOLL-LIKE RECEPTOR 2 (TLR-2) AGONIST FOR MODULATING HUMAN IMMUNE RESPONSE CHILDREN'S MEDICAL CENTER CORPORATION (US) 2023-04-27 — — US disclosed
US-20220118085-A9 USE OF TOLL-LIKE RECEPTOR 2 (TLR-2) AGONIST FOR MODULATING HUMAN IMMUNE RESPONSE CHILDREN'S MEDICAL CENTER CORPORATION (US) 2022-04-21 — — US disclosed
US-20210236632-A1 USE OF TOLL-LIKE RECEPTOR 2 (TLR-2) AGONIST FOR MODULATING HUMAN IMMUNE RESPONSE CHILDREN'S MEDICAL CENTER CORPORATION (US) 2021-08-05 — — US 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 (3 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-20220118085-A9 USE OF TOLL-LIKE RECEPTOR 2 (TLR-2) AGONIST FOR MODULATING HUMAN IMMUNE RESPONSE TLR2, TLR1, TLR3 ALDH1A1 4565/4885MAPT 206/4885KMT2A 2910/4885
US-20230132397-A9 USE OF TOLL-LIKE RECEPTOR 2 (TLR-2) AGONIST FOR MODULATING HUMAN IMMUNE RESPONSE TLR2, TLR1, TLR3 ALDH1A1 4565/4885MAPT 206/4885KMT2A 2910/4885
US-20210236632-A1 USE OF TOLL-LIKE RECEPTOR 2 (TLR-2) AGONIST FOR MODULATING HUMAN IMMUNE RESPONSE TLR2, TLR1, TLR3 ALDH1A1 4565/4885MAPT 206/4885KMT2A 2910/4885

“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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