SCHEMBL8524319

SCHEMBL8524319

Fc1ccc(-c2[nH]c3cc(F)ccc3c2C2CNCCC2F)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 20/20 1.00
KCNH2 Q12809 16/20 1.00
HTR2C P28335 11/20 1.00
DRD2 P14416 5/20 1.00

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
SCHEMBL8523885 0.94 HTR2A (1.00) HTR2AKCNH2HTR2CDRD2
SCHEMBL8525587 0.91 HTR2A (0.83) HTR2AKCNH2HTR2CDRD2
SCHEMBL8524501 0.91 HTR2A (0.85) HTR2AKCNH2HTR2CDRD2
SCHEMBL8525269 0.88 HTR2A (1.00) HTR2AKCNH2HTR2CDRD2
SCHEMBL8525623 0.85 HTR2A (0.80) HTR2AKCNH2HTR2CDRD2
SCHEMBL8524226 0.84 HTR2A (1.00) HTR2AKCNH2HTR2CDRD2
SCHEMBL8525101 0.82 HTR2A (0.72) HTR2AKCNH2HTR2CDRD2
SCHEMBL8524470 0.82 HTR2A (0.80) HTR2AKCNH2HTR2CDRD2
SCHEMBL8523771 0.81 HTR2A (1.00) HTR2AKCNH2HTR2CDRD2
SCHEMBL8524469 0.81 HTR2A (1.00) HTR2AKCNH2HTR2CDRD2

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
WO-1999047511-A1 INDOLE DERIVATIVES AS 5-HT2A RECEPTOR ANTAGONISTS MERCK SHARP & DOHME LIMITED (GB) 1999-09-23 WO claimed
WO-1999047511-A1 INDOLE DERIVATIVES AS 5-HT2A RECEPTOR ANTAGONISTS MERCK SHARP & DOHME LIMITED (GB) 1999-09-23 WO disclosed