SCHEMBL8074019

SCHEMBL8074019

OCC(O)C1CCN(c2cc3nc(S)[nH]c3cc2F)CC1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 17/20 0.44
EGLN1 Q9GZT9 1/20 0.37
FGFR1 P11362 2/20 0.33
FGFR2 P21802 2/20 0.33
FGFR3 P22607 2/20 0.33
KDR P35968 2/20 0.33
OPRM1 P35372 1/20 0.33
OPRK1 P41145 1/20 0.33

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
SCHEMBL8074378 0.82 OPRL1 (0.46) OPRL1EGLN1FGFR1FGFR2FGFR3
SCHEMBL8068945 0.78 OPRL1 (0.51) OPRL1EGLN1FGFR1FGFR2FGFR3
SCHEMBL8070777 0.77 EGLN1 (0.52) OPRL1EGLN1
SCHEMBL8071080 0.77 EGLN1 (0.52) OPRL1EGLN1
SCHEMBL8069366 0.76 OPRL1 (0.66) OPRL1EGLN1
SCHEMBL8069092 0.74 OPRL1 (0.57) OPRL1EGLN1FGFR1FGFR2FGFR3
SCHEMBL8070730 0.73 OPRL1 (0.47) OPRL1EGLN1FGFR1FGFR2FGFR3
SCHEMBL8071093 0.73 OPRL1 (0.44) OPRL1EGLN1FGFR1FGFR2FGFR3
SCHEMBL8074024 0.73 OPRL1 (0.40) OPRL1EGLN1FGFR1FGFR2FGFR3
SCHEMBL8075771 0.70 OPRL1 (0.37) OPRL1EGLN1

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-6051570-A ANTIULCER AGENTS DR. REDDY'S RESEARCH FOUNDATION (IN) 2000-04-18 US disclosed
EP-0983263-A1 NOVEL BENZIMIDAZOLE DERIVATIVES AS ANTIULCER AGENTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DR. REDDY'S RESEARCH FOUNDATION (IN) 2000-03-08 EP disclosed
WO-1998054172-A1 NOVEL BENZIMIDAZOLE DERIVATIVES AS ANTIULCER AGENTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DR. REDDY'S RESEARCH FOUNDATION (IN) 1998-12-03 WO disclosed