SCHEMBL7652993

SCHEMBL7652993

COc1cc(OC)c(Cc2ccccc2)cc1Br

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 6/20 0.55
GPR55 Q9Y2T6 1/20 0.46
MAPT P10636 1/20 0.45
HTR2C P28335 2/20 0.45
TAAR1 Q96RJ0 1/20 0.45

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
SCHEMBL15533244 0.93 HTR2A (0.62) HTR2AHTR2CTAAR1
SCHEMBL7637946 0.87 HTR2A (0.49) HTR2AGPR55MAPT
SCHEMBL15540748 0.85 HTR2A (0.45) HTR2AGPR55
SCHEMBL7630243 0.85 HTR2A (0.48) HTR2AGPR55MAPTHTR2C
SCHEMBL7636001 0.85 POLB (0.53) HTR2AGPR55
SCHEMBL15532149 0.82 HTR2A (0.51) HTR2AHTR2C
SCHEMBL1539339 0.80 SLC5A2 (0.53) HTR2A
SCHEMBL3766451 0.79 ALDH1A1 (0.46) GPR55MAPT
SCHEMBL3891823 0.79 LMNA (0.55) MAPT
SCHEMBL12185684 0.79 LTA4H (0.50) GPR55

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-6455549-B1 ANTIEPILEPTIC, ANTIISCHEMIC, AND ANTIMIGRAINE AGENTS; CALCIUM OVELOAD SUPPRESSANTS SUNTORY LIMITED (JP) 2002-09-24 US disclosed