SCHEMBL7052017

SCHEMBL7052017

c1ccc2c(c1)nnc1cocc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 3/20 0.64
LMNA P02545 2/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
LCK P06239 1/20 0.36
MAP2K3 P46734 1/20 0.36
MAP2K6 P52564 1/20 0.36
BTK Q06187 1/20 0.36
MAP3K19 Q56UN5 1/20 0.36
NEK10 Q6ZWH5 1/20 0.36
KDM4E B2RXH2 4/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C19 P33261 2/20 0.35
ALDH1A1 P00352 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
MAOA P21397 2/20 0.33
GLA P06280 1/20 0.33
CHRM2 P08172 1/20 0.33
ADRA2A P08913 1/20 0.33
ADORA3 P0DMS8 1/20 0.33

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
Benzonaphthyridine SCHEMBL29600756 0.80 GPR3 (1.00) GPR3LMNAHTTKMT2ALCK
Benzonaphthyridine SCHEMBL51197 0.80 GPR3 (1.00) GPR3LMNAHTTKMT2ALCK
Benzonaphthyridine SCHEMBL30897319 0.80 GPR3 (1.00) GPR3LMNAHTTKMT2ALCK
SCHEMBL4485428 0.74 GPR3 (0.87) GPR3LMNAHTTKMT2ALCK
SCHEMBL28540379 0.72 GPR3 (0.31) GPR3
SCHEMBL28548174 0.72 GPR3 (0.56) GPR3LMNAHTTKMT2ALCK
SCHEMBL28541824 0.71
SCHEMBL28534627 0.71
SCHEMBL249853 0.70 GPR3 (0.32) GPR3
SCHEMBL19683501 0.68 HPRT1 (0.40) GPR3KMT2AKDM4ECYP1A2ALDH1A1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0985674-B1 ORGANIC COMPOUNDS CONTAINING SILICON OR GERMANIUM, TRANSITION METAL COMPLEXES, CATALYST FOR ALPHA-OLEFIN POLYMERIZATION, AND PROCESSES FOR PRODUCING ALPHA-OLEFIN POLYMERS MITSUBISHI CHEM CORP (JP) 2003-04-23 EP disclosed
US-6255515-B1 COORDINATION POLYMERIZATION CATALYSTS MITSUBISHI CHEMICAL CORPORATION (JP) 2001-07-03 US disclosed
EP-0733649-B1 Peroxycarboxylic ester photoinitiators derived from nitrogen heterocycles MINNESOTA MINING & MFG (US) 2000-07-12 EP disclosed
EP-0985674-A1 ORGANIC COMPOUNDS CONTAINING SILICON OR GERMANIUM, TRANSITION METAL COMPLEXES, CATALYST FOR $g(a)-OLEFIN POLYMERIZATION, AND PROCESSES FOR PRODUCING $g(a)-OLEFIN POLYMERS MITSUBISHI CHEMICAL CORPORATION (JP) 2000-03-15 EP disclosed
US-5599652-A PHOTOPOLYMERIZABLE MIXTURES ALSO WITH FREE RADICAL POLYMERIZABLE COMPOUNDS AND PHOTOSENSITIZERS IMATION CORP. (US) 1997-02-04 US disclosed
EP-0733649-A1 Peroxycarboxylic ester initiators derived from nitrogen heterocycles MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-09-25 EP disclosed
US-5527921-A USEFUL IN PHOTOPOLYMERIZABLE COMPOSITIONS AND PHOTOSENSITIVE ELEMENTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-06-18 US disclosed