SCHEMBL8969231

SCHEMBL8969231

CNC(=O)Oc1cc2c(cc1Cl)N=C1C3CC4CC(C3)CC(C4)N1C2

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.35
ACHE P22303 1/20 0.35
HSD11B1 P28845 1/20 0.33
CTSD P07339 1/20 0.31

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
SCHEMBL8968687 0.87 MAOA (0.34) MAOAACHECTSD
SCHEMBL8969439 0.85
SCHEMBL8969440 0.82 ACHE (0.38) ACHE
SCHEMBL8968566 0.80 ACHE (0.32) ACHE
SCHEMBL8969986 0.80 MAOA (0.35) MAOAACHE
SCHEMBL8968441 0.80 MAOA (0.34) MAOAACHE
SCHEMBL8969194 0.79 CTSD (0.33) HSD11B1CTSD
SCHEMBL8969466 0.71 CTSD (0.49) ACHECTSD
SCHEMBL8968314 0.71 PDE3B (0.40) ACHECTSD
SCHEMBL8969417 0.70 MAOA (0.36) MAOAACHE

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