SCHEMBL7198624

SCHEMBL7198624

COc1ccc(CNc2nc(-c3cccnc3)nc3sc4c(c23)CCN(C(C)=O)C4)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 13/20 0.54
PDE5A O76074 4/20 0.46
PDE6D O43924 1/20 0.44
PDE6A P16499 1/20 0.44
PDE6G P18545 1/20 0.44
PDE6B P35913 1/20 0.44
PDE6C P51160 1/20 0.44
PDE6H Q13956 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL7195650 0.93 PRKCI (0.47) PRKCIKDM4EALDH1A1GAAMAPT
SCHEMBL5780971 0.86 KDM4E (0.54) PRKCIKDM4EALDH1A1GAAMAPT
SCHEMBL7169369 0.83 KDM4E (0.51) PRKCIKDM4EALDH1A1GAAMAPT
SCHEMBL7197493 0.83 KDM4E (0.44) PRKCIPDE5AKDM4EALDH1A1GAA
SCHEMBL5781064 0.79 KDM4E (0.55) PRKCIKDM4EALDH1A1GAAMAPT
SCHEMBL7015318 0.79 ALDH1A1 (0.48) PRKCIPDE5AKDM4EALDH1A1MAPT
SCHEMBL7008203 0.79 KDM4E (0.48) PRKCIPDE5AKDM4EALDH1A1MAPT
SCHEMBL7017308 0.78 PRKCI (0.50) PRKCIPDE5AKDM4EALDH1A1MAPT
SCHEMBL7169927 0.78 KDM4E (0.50) PRKCIKDM4EALDH1A1GAAMAPT
SCHEMBL5130031 0.78 SMN1; SMN2 (0.46) PRKCIPDE5AKDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1323719-A1 Thienopyrimidine compounds and salts thereof and process for the preparation of the same NIPPON SODA CO., LTD. (JP) 2003-07-02 EP disclosed
US-6482948-B1 Thienopyrimidine compounds and salts thereof and process for the preparation of the same NIPPON SODA CO., LTD. (JP) 2002-11-19 US disclosed
EP-1167367-A1 THIENOPYRIMIDINE COMPOUNDS AND SALTS THEREOF AND PROCESS FOR THE PREPARATION OF THE SAME NIPPON SODA CO., LTD. (JP) 2002-01-02 EP disclosed