SCHEMBL7430630

SCHEMBL7430630

CN(C)CCOC(=O)c1cccc(NC(=O)C(CS)Cc2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.48
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.45
CHRM1 P11229 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
MME P08473 1/20 0.43
FOLH1 Q04609 1/20 0.43
HIF1A Q16665 1/20 0.43
ALDH1A1 P00352 1/20 0.43
TP53 P04637 1/20 0.43
CASR P41180 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
SCHEMBL7435298 0.87 RAB9A (0.49) RAB9ALMNAMAPTSMN1; SMN2MME
SCHEMBL7440850 0.86 MAPT (0.60) RAB9AMAPTSMN1; SMN2ALDH1A1TP53
Hydrochloric Acid SCHEMBL7438277 0.86 CYP1A2 (0.47) RAB9ALMNAMAPTCHRM1SMN1; SMN2
SCHEMBL7434975 0.85 RAB9A (0.63) RAB9ALMNAMAPTMMEALDH1A1
SCHEMBL7433322 0.85 ALDH1A1 (0.58) RAB9ALMNASMN1; SMN2MMEFOLH1
SCHEMBL7425411 0.85 KMT2A (0.52) RAB9ALMNAMAPTSMN1; SMN2ALDH1A1
SCHEMBL7435418 0.82 NPSR1 (0.50) RAB9AMAPTSMN1; SMN2HIF1AALDH1A1
SCHEMBL7434594 0.81 RAB9A (0.47) RAB9ALMNAMAPTSMN1; SMN2MME
Hydrochloric Acid SCHEMBL7438272 0.80 RAB9A (0.44) RAB9AMAPTSMN1; SMN2HIF1AALDH1A1
SCHEMBL391430 0.80 FOLH1 (0.60) RAB9AMAPTMMEFOLH1ALDH1A1

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-5210266-A Analgesic enkephalinase inhibitors DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1993-05-11 US disclosed
US-5179125-A Analgesics DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1993-01-12 US disclosed
EP-0318859-A2 N-substituted mercaptopropanamide derivatives Dainippon Pharmaceutical Co., Ltd. (JP) 1989-06-07 EP disclosed