SCHEMBL8969635

SCHEMBL8969635

Cc1cc(C)c2c(c1)CN1C=CC=CC1=N2

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL8968375 0.85
SCHEMBL8969179 0.78 KDM4E (0.34) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL8969612 0.75 PDE3B (0.34) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL8968477 0.75 KDM4E (0.30) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL8969874 0.75 KDM4E (0.30) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL8970104 0.74 KDM4E (0.32) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL8968650 0.72 KDM4E (0.30) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL8969671 0.72 KDM4E (0.30) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL8968532 0.71 KDM4E (0.32) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL8969461 0.71 DRD1 (0.33) ALDH1A1

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