SCHEMBL6623749

SCHEMBL6623749

N#Cc1cnn2c(Cl)c(CCCl)c(Cl)nc12

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.45
KDM4C Q9H3R0 1/20 0.45
CDK2 P24941 2/20 0.44
KDM4E B2RXH2 7/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 2/20 0.40
GLA P06280 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 2/20 0.38
GAA P10253 1/20 0.38
KDM4D Q6B0I6 1/20 0.37
CSNK2A1 P68400 7/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
HSP90AA1 P07900 1/20 0.36

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
SCHEMBL9205154 0.89 KDM5A (0.54) KDM5AKDM4CCDK2KDM4EALDH1A1
SCHEMBL5438939 0.79 CDK2 (0.48) KDM5AKDM4CCDK2KDM4EALDH1A1
SCHEMBL6624351 0.77 KDM4E (0.57) KDM5AKDM4CCDK2KDM4EALDH1A1
SCHEMBL18863648 0.76 CDK2 (0.45) KDM5AKDM4CCDK2KDM4EALDH1A1
SCHEMBL16050622 0.75 CDK2 (0.51) KDM5AKDM4CCDK2KDM4EALDH1A1
SCHEMBL4875792 0.74 CDK2 (0.50) KDM5AKDM4CCDK2KDM4EALDH1A1
SCHEMBL9215707 0.70 DPP4 (0.34) KDM5AKDM4CCDK2KDM4EALDH1A1
SCHEMBL9213889 0.69 GSK3B (0.36) KDM5AKDM4CCDK2KDM4EALDH1A1
SCHEMBL6624070 0.69 KDM4E (0.49) KDM5AKDM4CCDK2KDM4EALDH1A1
SCHEMBL5230928 0.69 KDM4D (0.43) CDK2KDM4EALDH1A1HPGDHSD17B10

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-0976754-B1 REMEDIES/PREVENTIVES FOR RESPIRATORY DISEASES POLA CHEM IND INC (JP) 2004-07-14 EP disclosed
US-6329382-B1 TREATMENT OF RESPIRATORY DISEASES POLA CHEMICAL INDUSTRIES, INC. (JP) 2001-12-11 US disclosed
EP-0976754-A1 REMEDIES/PREVENTIVES FOR RESPIRATORY DISEASES POLA CHEMICAL INDUSTRIES, INC. (JP) 2000-02-02 EP disclosed