SCHEMBL8054640

SCHEMBL8054640

Cc1nc(CNC=O)sc1C

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.39
SLC6A3 Q01959 1/20 0.36
NOS1 P29475 1/20 0.34
ADH1B P00325 1/20 0.31
ADH1C P00326 1/20 0.31
ADH1A P07327 1/20 0.31
ADH7 P40394 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL22188405 0.81
SCHEMBL20744051 0.76 ALDH1A1 (0.30) ALDH1A1
SCHEMBL3246801 0.75 NOS1 (0.39) OPRM1SLC6A3NOS1NPC1RAB9A
SCHEMBL5898085 0.74
SCHEMBL14516134 0.74 OPRM1 (0.40) OPRM1SLC6A3NOS1NPC1RAB9A
SCHEMBL621509 0.74 SLC6A3 (0.39) OPRM1SLC6A3NOS1
SCHEMBL7497015 0.73 GAA (0.50) NPC1RAB9AALDH1A1GAA
SCHEMBL12808356 0.72 NOS1 (0.37) OPRM1SLC6A3NOS1NPC1RAB9A
SCHEMBL20743897 0.71
SCHEMBL28087107 0.69 SLC6A3 (0.36) OPRM1SLC6A3NOS1

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-0669336-B1 NOVEL CEPHEM DERIVATIVES MEIJI SEIKA CO (JP) 2000-05-17 EP disclosed
US-5663162-A BACTERICIDES AND ANTIBIOTICS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1997-09-02 US disclosed
EP-0669336-A1 NOVEL CEPHEM DERIVATIVE MEIJI SEIKA KABUSHIKI KAISHA (JP) 1995-08-30 EP disclosed