SCHEMBL8824985

SCHEMBL8824985

Cc1ccccc1COc1ccc2cc(C3SC(=O)N(C)C3=O)cnc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.39
MAOB P27338 3/20 0.36
KMT2A Q03164 1/20 0.35
CCNB2 O95067 1/20 0.35
CDK1 P06493 1/20 0.35
CDK4 P11802 1/20 0.35
CCNB1 P14635 1/20 0.35
CCND1 P24385 1/20 0.35
CCNB3 Q8WWL7 1/20 0.35
SLC26A4 O43511 1/20 0.35
S1PR1 P21453 1/20 0.34
S1PR5 Q9H228 1/20 0.34
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
ABL1 P00519 1/20 0.34
SRC P12931 1/20 0.34
GPR84 Q9NQS5 1/20 0.34
GNRHR P30968 1/20 0.34
ALOX5AP P20292 2/20 0.33
ALOX5 P09917 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
SCHEMBL8825018 0.90 MCHR1 (0.43) MAOBKMT2AALOX5AP
SCHEMBL8825046 0.89 PARP14 (0.40) MAOB
SCHEMBL8824934 0.89 NPC1 (0.40) KMT2AALOX5
SCHEMBL8825040 0.88 MEN1 (0.32) MAOBKMT2A
SCHEMBL8824960 0.87 MAOB (0.40) MAOBCDK1SRCALOX5APALOX5
SCHEMBL8824903 0.86 MAOB (0.41) MAOBKMT2AGPR84
SCHEMBL8824968 0.85 MAOB (0.41) MAOBKMT2AALOX5
SCHEMBL8824930 0.85 MCHR1 (0.43) KMT2A
SCHEMBL8824923 0.85 PDE10A (0.39)
SCHEMBL8825154 0.84 GAA (0.38) MAOBKMT2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5693651-A HYPOGLYCEMIC AGENTS NIPPON CHEMIPHAR CO., LTD. (JP) 1997-12-02 US disclosed