SCHEMBL7948479

SCHEMBL7948479

Fc1ccc2c(C3CCN(CCc4ccccc4)CC3)c(-c3ccccc3)[nH]c2c1

nearest known ligand 0.78

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 11/20 0.78
HTR2C P28335 6/20 0.78
KCNH2 Q12809 6/20 0.78
DRD2 P14416 5/20 0.78
CCR3 P51677 4/20 0.52
PRCP P42785 1/20 0.46

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
SCHEMBL7959411 0.92 HTR2A (0.78) HTR2AHTR2CKCNH2DRD2PRCP
SCHEMBL7958140 0.89 HTR2A (0.81) HTR2AHTR2CKCNH2DRD2
SCHEMBL7956248 0.89 HTR2A (0.85) HTR2AHTR2CKCNH2DRD2CCR3
SCHEMBL7948393 0.89 HTR2A (0.85) HTR2AHTR2CKCNH2DRD2CCR3
SCHEMBL7958684 0.89 HTR2A (0.61) HTR2AHTR2CKCNH2DRD2CCR3
SCHEMBL7962323 0.88 HTR2A (0.80) HTR2AHTR2CKCNH2DRD2
SCHEMBL7948313 0.88 HTR2A (1.00) HTR2AHTR2CKCNH2DRD2
SCHEMBL7948435 0.87 HTR2A (0.78) HTR2AHTR2CKCNH2DRD2PRCP
SCHEMBL7958429 0.87 HTR2A (0.81) HTR2AHTR2CKCNH2DRD2CCR3
SCHEMBL7948413 0.84 HTR2A (0.76) HTR2AHTR2CKCNH2DRD2PRCP

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
US-6316468-B1 Phenylindole derivatives as 5-HT2A receptor antagonists MERCK SHARP & DOHME LTD. 2001-11-13 US claimed
WO-1999011641-A1 PHENYLINDOLE DERIVATIVES AS 5-HT2A RECEPTOR ANTAGONISTS MERCK SHARP & DOHME LIMITED (GB) 1999-03-11 WO claimed
US-6316468-B1 Phenylindole derivatives as 5-HT2A receptor antagonists MERCK SHARP & DOHME LTD. 2001-11-13 US disclosed
WO-1999011641-A1 PHENYLINDOLE DERIVATIVES AS 5-HT2A RECEPTOR ANTAGONISTS MERCK SHARP & DOHME LIMITED (GB) 1999-03-11 WO disclosed