SCHEMBL8969063

SCHEMBL8969063

Fc1cccc2c1CN1C(=N2)C2CC3CC(C2)CC1C3

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.36
CHRNA7 P36544 2/20 0.36
CHRNA4 P43681 2/20 0.36
MAPK1 P28482 1/20 0.36
CTSD P07339 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
ACHE P22303 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
SCHEMBL8969774 0.84 HTR2C (0.36) CTSD
SCHEMBL8969113 0.84 CTSD (0.32) CTSD
SCHEMBL8968432 0.84 CTSD (0.48) CTSDACHE
SCHEMBL8969710 0.83 HTR2C (0.38) CHRNB2CHRNA4CTSD
SCHEMBL8969350 0.80
SCHEMBL8969424 0.79
SCHEMBL8969651 0.79
SCHEMBL8969988 0.78 CHRNB2 (0.35) CHRNB2CHRNA7CHRNA4ACHE
SCHEMBL9540235 0.77 CTSD (0.47) CTSDACHE
SCHEMBL8968559 0.76 PDE3B (0.44) CTSD

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 3 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
EP-0597956-A1 QUINAZOLINE DERIVATIVES AS ACETYLCHOLINESTERASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1994-05-25 EP disclosed
WO-1993003034-A1 QUINAZOLINE DERIVATIVES AS ACETYLCHOLINESTERASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1993-02-18 WO disclosed