SCHEMBL25801811

SCHEMBL25801811

C=C(Cc1nc(Cc2ccc(CCCCC)cc2)no1)C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.37
▸ SPHK1 Q9NYA1 1/20 0.36
▸ THRB P10828 6/20 0.36
▸ THRA P10827 5/20 0.36
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ FAAH O00519 1/20 0.34

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
SCHEMBL25801788 0.97 ALDH1A1 (0.36) ALDH1A1THRBTHRA
SCHEMBL25801971 0.93 MAPT (0.35) ALDH1A1MEN1KMT2A
SCHEMBL25801910 0.89 MAPT (0.41) ALDH1A1
SCHEMBL25802063 0.89 HPGD (0.36) ALDH1A1SPHK1THRBTHRA
SCHEMBL25433250 0.88 TP53 (0.32) ALDH1A1MEN1KMT2A
SCHEMBL29974028 0.87 MEN1 (0.39) ALDH1A1MEN1KMT2A
SCHEMBL23578283 0.87 MEN1 (0.39) ALDH1A1MEN1KMT2A
SCHEMBL27022900 0.87 CHRM2 (0.34) MEN1KMT2A
SCHEMBL23578580 0.86 CHRM2 (0.35) MEN1KMT2A
SCHEMBL23578249 0.86 CHRM2 (0.35) MEN1KMT2A

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-20230219907-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMATORY PROPERTIES SITRYX THERAPEUTICS LIMITED (GB) 2023-07-13 — — US disclosed
US-20230219907-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMATORY PROPERTIES SITRYX THERAPEUTICS LIMITED (GB) 2023-07-13 — — US disclosed
EP-4081511-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMMATORY PROPERTIES Sitryx Therapeutics Limited (GB) 2022-11-02 — — EP disclosed
CN-115066418-A Carboxy derivatives with anti-inflammatory properties 西特瑞治疗有限公司 2022-09-16 — — CN 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 (1 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-20230219907-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMATORY PROPERTIES CPA2, RO60, C5AR1 ALDH1A1 134/4885SPHK1 3875/4885THRB 4456/4885

“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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