SCHEMBL17150211

SCHEMBL17150211

Cc1nc(CO)c(-c2ccccc2F)s1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 6/20 0.41
HCRTR2 O43614 6/20 0.41
ALOX5 P09917 1/20 0.39
APEX1 P27695 1/20 0.38
GCGR P47871 1/20 0.38
HTR3A P46098 1/20 0.38
DHODH Q02127 1/20 0.38
ALDH1A1 P00352 2/20 0.37
HSD17B10 Q99714 2/20 0.37
ALOX15 P16050 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
HPGD P15428 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TRPV3 Q8NET8 1/20 0.36
TSPO P30536 1/20 0.36
OPRK1 P41145 1/20 0.36
HTR2B P41595 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
MGAM O43451 1/20 0.36

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
SCHEMBL327340 0.78 CDK4 (0.49) HCRTR1HCRTR2ALOX5ALDH1A1NPC1
SCHEMBL2096848 0.76 HCRTR1 (0.40) HCRTR1HCRTR2ALOX5APEX1ALDH1A1
SCHEMBL269323 0.74 HCRTR1 (0.53) HCRTR1HCRTR2ALOX5DHODHNPC1
SCHEMBL30775061 0.74 HCRTR1 (0.53) HCRTR1HCRTR2ALOX5DHODHNPC1
SCHEMBL30775082 0.74 HCRTR1 (0.52) HCRTR1HCRTR2ALDH1A1HSD17B10NPC1
SCHEMBL269010 0.74 HCRTR1 (0.52) HCRTR1HCRTR2ALDH1A1HSD17B10NPC1
SCHEMBL13448331 0.73 TRPM8 (0.44) HCRTR1HCRTR2ALOX5GCGRMGAM
SCHEMBL28786373 0.72 AKR1B1 (0.40) HCRTR1HCRTR2ALDH1A1
SCHEMBL14631967 0.71 HCRTR1 (0.45) HCRTR1HCRTR2ALOX5DHODHALDH1A1
SCHEMBL2095462 0.69 MBNL1 (0.45) APEX1ALDH1A1NPC1RAB9AMGAM

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
WO-2015152368-A1 OXAZOLIDINONE AND OXAZINANONE DERIVATIVES 大正製薬株式会社 2015-10-08 WO disclosed