SCHEMBL8968188

SCHEMBL8968188

N=c1c2c(Br)cccc2nc2n1C1CC3CC(CC2C3)C1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.32
OPRL1 P41146 3/20 0.30
OGFRL1 Q5TC84 3/20 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
SCHEMBL8969422 0.85 HRH4 (0.34) ACHEOPRL1OGFRL1
SCHEMBL8968270 0.82
SCHEMBL8969363 0.80
SCHEMBL8968252 0.80
SCHEMBL8969949 0.79 HRH4 (0.32)
SCHEMBL8968293 0.76
SCHEMBL8968555 0.74 MPO (0.36) ACHE
SCHEMBL8968897 0.74 BCHE (0.31) ACHE
SCHEMBL13218902 0.71 OPRL1 (0.50) OPRL1OGFRL1
SCHEMBL16502864 0.71 OPRL1 (0.50) OPRL1OGFRL1

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