SCHEMBL7293294

SCHEMBL7293294

O=[C]C(Cc1c[nH]cn1)NC(=O)C(CCc1ccccc1)Cc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 1/20 0.39
▸ FCER2 P06734 1/20 0.39
▸ ERAP2 Q6P179 7/20 0.39
▸ LNPEP Q9UIQ6 5/20 0.39
▸ ERAP1 Q9NZ08 4/20 0.39
▸ IL1RN P18510 1/20 0.39
▸ MMP12 P39900 2/20 0.38
▸ CTSC P53634 1/20 0.38
▸ MMP3 P08254 1/20 0.38
▸ LAP3 P28838 3/20 0.37
▸ ANPEP P15144 1/20 0.37

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
SCHEMBL7293298 1.00 MMP1 (0.39) MMP1FCER2ERAP2LNPEPERAP1
SCHEMBL7287009 0.94 MMP2 (0.44) MMP1MMP3
SCHEMBL7287005 0.94 MMP2 (0.44) MMP1MMP3
SCHEMBL7287864 0.93 MMP3 (0.44) MMP1MMP3
SCHEMBL7287870 0.93 MMP3 (0.44) MMP1MMP3
SCHEMBL7292510 0.92 CTSL (0.40) MMP1FCER2CTSC
SCHEMBL7292514 0.92 CTSL (0.40) MMP1FCER2CTSC
SCHEMBL7302898 0.85 GLS (0.39) CTSC
SCHEMBL7302891 0.85 GLS (0.39) CTSC
SCHEMBL9012384 0.84 CTSC (0.54) CTSC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0264106-B1 5-Substituted amino-4-hydroxy-pentanoic acid derivatives and their use BANYU PHARMA CO LTD (JP) 1994-03-16 — — EP disclosed
US-4851387-A RENIN INHIBITORS BANYU PHARMACEUTICAL CO., LTD. (JP) 1989-07-25 — — US disclosed
EP-0264106-A2 5-Substituted amino-4-hydroxy-pentanoic acid derivatives and their use Banyu Pharmaceutical Co., Ltd. (JP) 1988-04-20 — — EP disclosed
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