SCHEMBL9153434

SCHEMBL9153434

Cc1cccc(C(CC(=O)Cl)C2CCCC2)c1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.42
▸ RAB9A P51151 4/20 0.42
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ EPHX1 P07099 1/20 0.39
▸ HTR1E P28566 1/20 0.39
▸ S1PR3 Q99500 1/20 0.39
▸ C3AR1 Q16581 1/20 0.38
▸ FFAR1 O14842 2/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ CYP2C19 P33261 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
SCHEMBL9152577 0.87 FFAR1 (0.51) NPC1RAB9AMEN1KMT2AFFAR1
SCHEMBL9150014 0.82 FFAR1 (0.44) NPC1RAB9AMEN1KMT2AEPHX1
SCHEMBL27396211 0.81 MEN1 (0.41) MEN1KMT2AEPHX1FFAR1CYP3A4
SCHEMBL9413697 0.81 SLC6A2 (0.41) NPC1RAB9AMEN1KMT2ANPSR1
SCHEMBL9413682 0.81 GPR119 (0.39) NPC1RAB9AMEN1KMT2AFFAR1
SCHEMBL18501542 0.78 FFAR1 (0.43) NPC1RAB9AKMT2AFFAR1
SCHEMBL18501544 0.78 FFAR1 (0.43) NPC1RAB9AKMT2AFFAR1
SCHEMBL7453051 0.77 PKM (0.40) NPC1RAB9AMEN1KMT2AC3AR1
SCHEMBL27396973 0.74 MEN1 (0.42) NPC1RAB9AMEN1KMT2AEPHX1
SCHEMBL9413695 0.74 NPC1 (0.37) NPC1RAB9AMEN1KMT2AHPGD

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
US-5414008-A Hypotensive and antiatherosclerotic agents BAYER AKTIENGESELLSCHAFT (DE) 1995-05-09 — — US disclosed
EP-0578002-A1 Imidazolyl substituted phenylpropionic and cinnamic acid derivatives BAYER AG (DE) 1994-01-12 — — EP disclosed
Send feedback