SCHEMBL10674370

SCHEMBL10674370

CCCCNC(=O)CCCCc1nnnn1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 5/20 0.52
▸ NPC1 O15118 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ KMT2A Q03164 1/20 0.49
▸ HPGD P15428 1/20 0.47
▸ DAGLA Q9Y4D2 2/20 0.47
▸ EPHX2 P34913 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ RXFP1 Q9HBX9 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.44
▸ GHSR Q92847 1/20 0.43

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
SCHEMBL10675268 0.97 HSD11B1 (0.53) HSD11B1NPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL10676166 0.96 HPGD (0.51) HSD11B1NPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL10680871 0.90 HSD11B1 (0.55) HSD11B1SMN1; SMN2DAGLATP53ALDH1A1
SCHEMBL10681785 0.83 HSD11B1 (0.47) HSD11B1NPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL4406817 0.81 HSD11B1 (0.54) HSD11B1SMN1; SMN2KMT2AALDH1A1
SCHEMBL10670995 0.80 HSD11B1 (0.64) HSD11B1NPC1RAB9AKMT2ARXFP1
SCHEMBL10681783 0.80 ALDH1A1 (0.60) SMN1; SMN2KMT2ATP53ALDH1A1
SCHEMBL22716411 0.80 HSD11B1 (0.52) HSD11B1KMT2AALDH1A1
SCHEMBL4413278 0.80 HSD11B1 (0.52) HSD11B1KMT2AALDH1A1
SCHEMBL4407255 0.80 HSD11B1 (0.55) HSD11B1SMN1; SMN2KMT2AHPGDTP53

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
US-4766120-A ANTIINFLAMMATORY AGENTS OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1988-08-23 — — US disclosed
US-4663323-A Tetrazole derivatives, anti-ulcer composition containing the same and method for treating ulcers OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1987-05-05 — — US disclosed
US-4540703-A Tetrazole derivatives, anti-ulcer composition containing the same and method for treating ulcers OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1985-09-10 — — US disclosed
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