SCHEMBL7316348

SCHEMBL7316348

CN(Cc1ccccc1)C(=O)CCC(=O)C1NSC[C@H]1C=O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.53
▸ RAB9A P51151 3/20 0.53
▸ KMT2A Q03164 1/20 0.47
▸ CDK4 P11802 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ CA12 O43570 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ MAPK1 P28482 1/20 0.37
▸ RIPK1 Q13546 1/20 0.37
▸ AOC3 Q16853 1/20 0.37
▸ TSPO P30536 1/20 0.37
▸ MAOA P21397 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
SCHEMBL7319236 0.90 RAB9A (0.40) NPC1RAB9AKMT2ASMN1; SMN2ALDH1A1
SCHEMBL7321020 0.89 RAB9A (0.45) NPC1RAB9AKMT2ASMN1; SMN2ALDH1A1
SCHEMBL7318536 0.87 SMN1; SMN2 (0.46) NPC1RAB9AKMT2ASMN1; SMN2ALDH1A1
SCHEMBL10584472 0.86 SLC6A2 (0.39) NPC1RAB9AKMT2AALDH1A1
SCHEMBL7316423 0.86 ALDH1A1 (0.43) NPC1RAB9AKMT2ASMN1; SMN2ALDH1A1
SCHEMBL7318664 0.81 CNR2 (0.41) NPC1RAB9AKMT2ASMN1; SMN2ALDH1A1
SCHEMBL7370142 0.77 NR4A2 (0.41) NPC1RAB9AKMT2ASMN1; SMN2ALDH1A1
SCHEMBL7323963 0.77 GAA (0.46) NPC1RAB9AKMT2AALDH1A1
SCHEMBL7375083 0.70 TDP1 (0.39) KMT2AALDH1A1
SCHEMBL7316351 0.70 NPC1 (0.55) NPC1RAB9AKMT2ACDK4SMN1; SMN2

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-0280956-B1 THIAZOLIDINE DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 1992-10-21 — — EP claimed
US-4857537-A PREVENTING AMNESIA ONO PHARMACEUTICAL CO., LTD. (JP) 1989-08-15 — — US claimed
EP-0280956-A1 Thiazolidine derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1988-09-07 — — EP claimed
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