SCHEMBL8969472

SCHEMBL8969472

FC(F)(F)c1cccc2c1N=C1C3C=CC(C3)N1C2

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.32
HTR2C P28335 2/20 0.32
HTR2B P41595 1/20 0.32
TEAD1 P28347 1/20 0.30
TEAD4 Q15561 1/20 0.30
TEAD2 Q15562 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
SCHEMBL8968445 0.83
SCHEMBL8969573 0.81 HTR2C (0.32) HTR2CHTR2B
SCHEMBL8970272 0.77
SCHEMBL8968570 0.74 HTR2C (0.36) HTR2AHTR2CHTR2B
SCHEMBL8968900 0.70 HTR2A (0.33) HTR2AHTR2CHTR2B
SCHEMBL8969954 0.67 EGFR (0.34)
SCHEMBL8969134 0.65
SCHEMBL8969474 0.64 CTSD (0.30)
SCHEMBL8969224 0.64 CTSD (0.30)
SCHEMBL8968716 0.64 CTSD (0.46)

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
US-5486512-A LEARNING ENHANCEMENT WARNER-LAMBERT COMPANY (US) 1996-01-23 US disclosed
WO-1993003034-A1 QUINAZOLINE DERIVATIVES AS ACETYLCHOLINESTERASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1993-02-18 WO disclosed