SCHEMBL8969519

SCHEMBL8969519

CC1c2c(Cl)cc(Cl)cc2N=C2CCCN21

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KLK7 P49862 1/20 0.49
ACHE P22303 6/20 0.35
GLA P06280 1/20 0.32

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
SCHEMBL8969356 0.87 KLK7 (0.39) KLK7
SCHEMBL8969197 0.87 KLK7 (0.42) KLK7ACHEGLA
SCHEMBL8969429 0.78 KLK7 (0.56) KLK7ACHE
SCHEMBL9382150 0.72 ACHE (0.51) KLK7ACHE
SCHEMBL9380049 0.69 ACHE (0.51) KLK7ACHE
SCHEMBL8968233 0.66 ACHE (0.57) KLK7ACHE
SCHEMBL8968620 0.66 KLK7 (0.37) KLK7ACHE
Hydrochloric Acid SCHEMBL8969536 0.65 ACHE (0.56) KLK7ACHE
SCHEMBL9383664 0.64 ACHE (0.45) KLK7ACHEGLA
SCHEMBL8970145 0.63

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