SCHEMBL11024975

SCHEMBL11024975

N#Cc1cnn(-c2ccc(Cl)cc2Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.42
SCN9A Q15858 2/20 0.42
KDM4E B2RXH2 2/20 0.36
LMNA P02545 1/20 0.36
ALOX12 P18054 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KCNH2 Q12809 4/20 0.35
MRGPRX4 Q96LA9 1/20 0.34
PKM P14618 1/20 0.34
GRM5 P41594 2/20 0.34
SIGMAR1 Q99720 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
CCNT1 O60563 1/20 0.33
CDK1 P06493 1/20 0.33
CDK4 P11802 1/20 0.33
CCNB1 P14635 1/20 0.33
CCND1 P24385 1/20 0.33
CCNE1 P24864 1/20 0.33
CDK2 P24941 1/20 0.33
CCND3 P30281 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
SCHEMBL18797548 0.85 SCN9A (0.33) SCN9AKDM4EGRM5L3MBTL1
SCHEMBL11023797 0.85 JAK2 (0.38) SCN9AGRM5MEN1MAPK1KMT2A
SCHEMBL11131247 0.85 BCHE (0.40) SCN9AGRM5CCNT1CDK1CDK4
SCHEMBL18328251 0.81 F11 (0.33) SCN9AKDM4EKCNH2GRM5
SCHEMBL11134713 0.81 GABRB3 (0.41) NOTUMKDM4EKCNH2MRGPRX4L3MBTL1
SCHEMBL11135859 0.81 CYP2A6 (0.40) CCNT1CDK1CDK4CCNB1CCND1
SCHEMBL27686519 0.81 BCHE (0.41) NOTUMKDM4EGRM5L3MBTL1
SCHEMBL10537587 0.79 NOTUM (0.42) NOTUMNPSR1GRM5
SCHEMBL16810229 0.78 NOTUM (0.43) NOTUMSCN9AKDM4ELMNAALOX12
SCHEMBL24257824 0.76 NOTUM (0.45) NOTUMLMNAALOX12NPSR1KCNH2

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
EP-0034945-B1 N-PHENYLPYRAZOLE DERIVATIVES MAY & BAKER LIMITED (GB) 1985-08-07 EP claimed