SCHEMBL7982185

SCHEMBL7982185

O=C1CC=CC2=C1CNc1ccccc1N2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
ALDH1A1 P00352 1/20 0.33
BRPF1 P55201 1/20 0.33
PDGFRA P16234 1/20 0.32
FER P16591 1/20 0.32
LTK P29376 1/20 0.32
CDK8 P49336 1/20 0.32
ACVR1 Q04771 1/20 0.32
LRRK2 Q5S007 1/20 0.32
DYRK1B Q9Y463 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
BRD4 O60885 4/20 0.31
CREBBP Q92793 3/20 0.31
AHR P35869 1/20 0.31
PDK2 Q15119 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31
EP300 Q09472 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
SCHEMBL5503704 0.82 CHEK1 (0.38) MEN1KMT2AMAPTAHRMAPK13
SCHEMBL1290778 0.79 SMYD3 (0.36) MEN1KMT2ABRD4MAPK14
SCHEMBL28552531 0.77 AHR (0.50) MEN1KMT2AKDM4EMAPTBRD4
SCHEMBL28517190 0.75 PDGFRA (0.35) MEN1KMT2ABRPF1PDGFRAFER
SCHEMBL8590983 0.75 ACVR1 (0.44) MEN1KMT2APDGFRAFERLTK
SCHEMBL2143931 0.72 GAA (0.45) MEN1KMT2ABRPF1MAPT
SCHEMBL20525381 0.72 MEN1 (0.35) MEN1KMT2AALDH1A1BRPF1MAPT
SCHEMBL8201662 0.71 BRD4 (0.43) MEN1KMT2AALDH1A1BRPF1KDM4E
SCHEMBL10969348 0.70 HTR5A (0.41) MEN1KMT2AKDM4EMAPTBRD4
SCHEMBL29483964 0.68 AHR (0.50) MEN1KMT2AALDH1A1BRPF1PDGFRA

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-6235730-B1 ANTICHOLESTEROL AGENT, ANTILIPEMIC AGENT JAPAN TOBACCO, INC. (JP) 2001-05-22 US disclosed
EP-0970954-A1 3-PIPERIDYL-4-OXOQUINAZOLINE DERIVATIVES AND MEDICINCAL COMPOSITIONS CONTAINING THE SAME JAPAN TOBACCO INC. (JP) 2000-01-12 EP disclosed