SCHEMBL7062971

SCHEMBL7062971

CCCc1ccc(CCc2cc(F)c3c(c2)CC(CC)C3)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.33
HTR2B P41595 2/20 0.33
HTR2A P28223 1/20 0.33
DRD2 P14416 5/20 0.32
DRD3 P35462 5/20 0.32
GPR84 Q9NQS5 1/20 0.32
NISCH Q9Y2I1 1/20 0.31
HTR1D P28221 1/20 0.31
PTGS1 P23219 1/20 0.30
PTGS2 P35354 1/20 0.30
LPL P06858 1/20 0.30
LIPG Q9Y5X9 1/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
GFER P55789 1/20 0.30
ACACB O00763 1/20 0.30
GRIK2 Q13002 1/20 0.30

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
SCHEMBL7061283 0.89 NR3C2 (0.31) HTR2CHTR2BHTR2ADRD2DRD3
SCHEMBL7062989 0.80 CYP3A4 (0.37) PTGS2
SCHEMBL7652848 0.75 TAAR1 (0.37) DRD2DRD3GPR84PTGS1PTGS2
SCHEMBL27423989 0.75 ADRA2A (0.32)
SCHEMBL7061221 0.73 CYP3A4 (0.39) HTR2CHTR2ADRD2GPR84PTGS2
SCHEMBL7060962 0.71 CYP3A4 (0.36) HTR2CHTR2ADRD2MAPT
SCHEMBL7064836 0.71 HTR1D (0.31) HTR1D
SCHEMBL7064983 0.71 FYN (0.33)
SCHEMBL14449818 0.70 HTR2A (0.31) HTR2CHTR2BHTR2A
SCHEMBL32686719 0.68 DRD2 (0.48) DRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1027403-B1 5-ARYLINDANE DERIVATIVES AND FERROELECTRIC LIQUID CRYSTAL MIXTURE CONTAINING SAME AVENTIS RES & TECH GMBH & CO (DE) 2003-05-28 EP disclosed
US-6485797-B1 5-Arylindane derivatives and ferroelectric liquid crystal mixture containing same AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO. KG (DE) 2002-11-26 US disclosed
EP-1027403-A2 5-ARYLINDANE DERIVATIVES AND FERROELECTRIC LIQUID CRYSTAL MIXTURE CONTAINING SAME Aventis Research & Technologies GmbH & Co. KG (DE) 2000-08-16 EP disclosed
WO-1999019420-A2 5-ARYLINDANE DERIVATIVES AND FERROELECTRIC LIQUID CRYSTAL MIXTURE CONTAINING SAME AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO. KG (DE) 1999-04-22 WO disclosed