SCHEMBL9646806

SCHEMBL9646806

Cc1c(Cc2c[nH]cn2)ccc(O)c1C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CA7 P43166 1/20 0.32
▸ CA9 Q16790 1/20 0.32
▸ CA14 Q9ULX7 1/20 0.32
▸ METAP2 P50579 1/20 0.32
▸ BID P55957 3/20 0.31
▸ MCL1 Q07820 3/20 0.31
▸ BCL2L1 Q07817 2/20 0.31
▸ BAK1 Q16611 2/20 0.31
▸ KAT8 Q9H7Z6 2/20 0.31
▸ PPARG P37231 1/20 0.31
▸ PPARA Q07869 1/20 0.31
▸ EP300 Q09472 1/20 0.31
▸ KAT2A Q92830 1/20 0.31
▸ KAT2B Q92831 1/20 0.31
▸ KAT5 Q92993 1/20 0.31
▸ SAE1 Q9UBE0 1/20 0.31
▸ PRKCI P41743 1/20 0.31

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
SCHEMBL9648217 0.88 PKMYT1 (0.34) PRKCI
Hydrochloric Acid SCHEMBL10401606 0.87 PKMYT1 (0.33) —
SCHEMBL9646843 0.86 PRKCI (0.35) CA12CA1CA2CA7CA9
SCHEMBL10401559 0.85 CA12 (0.46) CA12CA1CA2CA7CA9
SCHEMBL9647525 0.81 P2RX3 (0.34) LDHALDHB
SCHEMBL9647120 0.77 PRKCI (0.34) PRKCI
SCHEMBL10401616 0.76 CA12 (0.41) CA12CA1CA2CA7CA9
Hydrochloric Acid SCHEMBL10402300 0.76 PRKCI (0.33) PRKCI
Detomidine SCHEMBL28311140 0.74 KDM4C (0.36) PPARGPPARA
Detomidine SCHEMBL20362214 0.73 KDM4C (0.38) PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0341231-B1 SUBSTITUTED 1-(1H-IMIDAZOL-4-YL)ALKYL BENZAMIDES U C B, S.A. (BE) 1992-11-19 — — EP disclosed
EP-0341231-A1 Substituted 1-(1H-imidazol-4-yl)alkyl benzamides U C B, S.A. (BE) 1989-11-08 — — EP disclosed
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