SCHEMBL11184479

SCHEMBL11184479

CC(CSC(=O)c1ccccc1)C(=O)N1C(c2ccco2)SC[C@H]1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FFAR2 O15552 1/20 0.52
▸ ACE P12821 4/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ HSD17B10 Q99714 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL11190606 0.89 FFAR2 (0.51) FFAR2ACEKMT2AHSD17B10KDM4E
SCHEMBL11110226 0.86 ACE (0.53) FFAR2ACEKMT2AHSD17B10MEN1
SCHEMBL11180379 0.83 FFAR2 (0.52) FFAR2ACEKMT2AHSD17B10KDM4E
SCHEMBL11068373 0.82 KMT2A (0.50) FFAR2ACEKMT2AHSD17B10MEN1
SCHEMBL11062257 0.82 ACE (0.55) FFAR2ACEKMT2A
SCHEMBL11248462 0.81 KMT2A (0.49) FFAR2ACEKMT2AHSD17B10MEN1
SCHEMBL11065209 0.81 ACE (0.49) FFAR2ACEKMT2A
SCHEMBL11169739 0.81 ACE (0.49) FFAR2ACEKMT2A
SCHEMBL11184480 0.79 FFAR2 (0.52) FFAR2ACEKMT2AHSD17B10KDM4E
SCHEMBL11234749 0.79 ACE (0.47) FFAR2ACEKMT2AHSD17B10KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4386096-A ANGIOTENSIN-CONVERTING ENZYME INHIBITORS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1983-05-31 — — US claimed
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