SCHEMBL5489325

SCHEMBL5489325

N#CSc1cnn2c(Cl)cc(Cl)nc12

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 1/20 0.38
PDE10A Q9Y233 1/20 0.37
USP2 O75604 1/20 0.36
USP8 P40818 1/20 0.36
USP5 P45974 1/20 0.36
USP4 Q13107 1/20 0.36
USP7 Q93009 1/20 0.36
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 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
SCHEMBL15288383 0.76 CDK2 (0.61) CDK2PDE10AKDM4EALDH1A1
SCHEMBL12953072 0.72 PDE10A (0.46) CDK2PDE10AKDM4EALDH1A1MAPT
SCHEMBL13484231 0.69 PDE10A (0.43) CDK2PDE10AKDM4EALDH1A1MAPT
SCHEMBL13901457 0.69 PDE10A (0.43) CDK2PDE10AKDM4EALDH1A1MAPT
SCHEMBL3319549 0.69 PDE10A (0.43) CDK2PDE10AUSP2KDM4EALDH1A1
SCHEMBL23994248 0.69 PDE10A (0.43) CDK2PDE10AKDM4EALDH1A1MAPT
SCHEMBL13650606 0.69 ALDH1A1 (0.44) CDK2PDE10AKDM4EALDH1A1MAPT
SCHEMBL1370649 0.66 CDK2 (0.40) CDK2PDE10AKDM4EALDH1A1MAPT
SCHEMBL5119212 0.66 PDE10A (0.40) CDK2PDE10AKDM4EALDH1A1MAPT
SCHEMBL24477477 0.66 KDM4E (0.53) PDE10AKDM4EALDH1A1MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7667036-B2 MAPKAP-K2 (mitogen-activated protein kinase-activated protein kinase 2) inhibitors; inflammatory, autoimmune disease, destructive bone disorder, cancer and/or tumor growth; angiogenesis, diabetes and neurological disorders TEIJIN PHARMA LIMITED (JP) 2010-02-23 US disclosed
US-7557110-B2 MAPKAP-K2; inflammatory disease, autoimmune disease, destructive bone disorder, cancer and/or tumour growth; 5-[(trans-4-aminocyclohexyl)amino]-3-fluoro-6-methyl(pyrazolo[1,5-a]pyri- midin-7-yl)}(4-iodophenyl)amine TEIJIN PHARMA LIMITED (JP) 2009-07-07 US disclosed
US-7557110-B2 MAPKAP-K2; inflammatory disease, autoimmune disease, destructive bone disorder, cancer and/or tumour growth; 5-[(trans-4-aminocyclohexyl)amino]-3-fluoro-6-methyl(pyrazolo[1,5-a]pyri- midin-7-yl)}(4-iodophenyl)amine TEIJIN PHARMA LIMITED (JP) 2009-07-07 US disclosed
EP-1780212-A1 PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVE Teijin Pharma Limited (JP) 2007-05-02 EP disclosed