SCHEMBL8969217

SCHEMBL8969217

Clc1ccc2c(c1Cl)CN1C=CC=CC1=N2

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 2/20 0.43
PDE3A Q14432 2/20 0.43
MEN1 O00255 1/20 0.43
PDE2A O00408 1/20 0.43
KMT2A Q03164 1/20 0.43
P2RY12 Q9H244 1/20 0.43
PNMT P11086 2/20 0.31
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
SCHEMBL8968208 0.85 PDE3B (0.31) PDE3BPDE3AMEN1PDE2AKMT2A
SCHEMBL8968430 0.85 MEN1 (0.31) PDE3BPDE3AMEN1PDE2AKMT2A
SCHEMBL8968378 0.81 ACHE (0.43) PDE3BPDE3AKDM4EALDH1A1POLB
SCHEMBL8969664 0.78 KDM4E (0.30) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL8969637 0.78
SCHEMBL8969847 0.78 KDM4E (0.35) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL8970095 0.76
SCHEMBL8969815 0.76
SCHEMBL8969286 0.76
SCHEMBL8969652 0.76

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