SCHEMBL28628741

SCHEMBL28628741

CCc1c(NNC)[nH]c2c(C#N)cnn2c1=O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 12/20 0.48
▸ KDM4C Q9H3R0 1/20 0.38
▸ PLAT P00750 2/20 0.37
▸ KDM4E B2RXH2 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ KDM4D Q6B0I6 1/20 0.35
▸ HPGD P15428 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ POLB P06746 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ RECQL P46063 1/20 0.30
▸ CDK2 P24941 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
SCHEMBL16050639 0.82 KDM5A (0.52) KDM5AKDM4CPLATKDM4EALDH1A1
SCHEMBL16047075 0.81 KDM5A (0.49) KDM5AKDM4CPLATKDM4EALDH1A1
SCHEMBL16046987 0.81 KDM5A (0.56) KDM5AKDM4CPLATKDM4EALDH1A1
SCHEMBL18159119 0.81 KDM5A (0.53) KDM5AKDM4CPLATKDM4EALDH1A1
SCHEMBL16047129 0.80 KDM5A (0.50) KDM5AKDM4CPLATKDM4EALDH1A1
SCHEMBL16046199 0.79 KDM5A (0.46) KDM5AKDM4CPLATKDM4EALDH1A1
SCHEMBL16046543 0.78 KDM5A (0.50) KDM5AKDM4CPLATKDM4EALDH1A1
SCHEMBL16048043 0.78 KDM5A (0.50) KDM5AKDM4CPLATKDM4EALDH1A1
SCHEMBL16049130 0.77 KDM5A (0.49) KDM5AKDM4CPLATKDM4EALDH1A1
SCHEMBL16048319 0.77 KDM5A (0.49) KDM5AKDM4CPLATKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105980386-B Pyrazolo compounds and uses thereof 基因泰克公司 2021-08-13 — — CN disclosed
Send feedback