SCHEMBL9026518

SCHEMBL9026518

COc1c(Cc2c[nH]c3ccc(Br)cc23)[nH]c(=O)c(CC(C)C)[n+]1[O-]

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 3/20 0.44
MTNR1B P49286 3/20 0.38
HTR2A P28223 2/20 0.37
TRPM8 Q7Z2W7 1/20 0.37
HTR1A P08908 2/20 0.37
MTNR1A P48039 1/20 0.36
AHR P35869 1/20 0.36
CSNK2A1 P68400 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
SLC6A4 P31645 1/20 0.36
PDE4D Q08499 1/20 0.35
NR4A2 P43354 1/20 0.35

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
SCHEMBL9026223 0.90 PCSK9 (0.39) GPR84MTNR1BHTR2AHTR1AMTNR1A
SCHEMBL9026430 0.90 GPR84 (0.51) GPR84MTNR1BHTR2ATRPM8HTR1A
SCHEMBL9026831 0.89 IDO1 (0.45) GPR84MTNR1BHTR2ATRPM8HTR1A
SCHEMBL9026796 0.89 HTR2C (0.44) GPR84HTR2AHTR1AHTR2CHTR2B
SCHEMBL9027294 0.89 GPR84 (0.44) GPR84MTNR1BHTR2ATRPM8HTR1A
SCHEMBL9025829 0.86 MAPT (0.42) GPR84HTR2AHTR1AAHRHTR2C
SCHEMBL9027098 0.78 SOS2 (0.43) HTR2AAHRNR4A2
SCHEMBL9486584 0.78 AHR (0.40) GPR84HTR2AHTR1AAHRHTR2C
SCHEMBL9027577 0.78 MAPT (0.41) HTR2AHTR1AHTR2CHTR2BSLC6A4
SCHEMBL9026487 0.77 AHR (0.39) GPR84HTR2AHTR1AAHRHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0411150-B1 INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME OTSUKA PHARMA CO LTD (JP) 1996-11-27 EP disclosed
EP-0411150-A1 INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-02-06 EP disclosed