SCHEMBL31237795

SCHEMBL31237795

C/C(=N\Nc1ccc(Cl)cn1)c1ccccn1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.68
KDM6B O15054 1/20 0.68
TET3 O43151 1/20 0.68
KDM4A O75164 1/20 0.68
KDM4B O94953 1/20 0.68
KDM5A P29375 1/20 0.68
KDM5C P41229 1/20 0.68
KDM4D Q6B0I6 1/20 0.68
TET2 Q6N021 1/20 0.68
TET1 Q8NFU7 1/20 0.68
KDM4C Q9H3R0 1/20 0.68
KDM5B Q9UGL1 1/20 0.68
KMT2A Q03164 7/20 0.67
GAA P10253 6/20 0.67
SMN1; SMN2 Q16637 5/20 0.67
MAPT P10636 4/20 0.67
RAB9A P51151 4/20 0.67
MEN1 O00255 4/20 0.67
TDP1 Q9NUW8 2/20 0.67
ALDH1A1 P00352 1/20 0.67

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
SCHEMBL30539398 0.86 KDM4E (0.85) KDM4EKDM6BTET3KDM4AKDM4B
SCHEMBL6715793 0.84 PAX8 (0.67) KDM4EKMT2AGAASMN1; SMN2MAPT
SCHEMBL20101085 0.84 PAX8 (0.67) KDM4EKMT2AGAASMN1; SMN2MAPT
SCHEMBL6715790 0.84 PAX8 (0.67) KDM4EKMT2AGAASMN1; SMN2MAPT
SCHEMBL29353093 0.81 KDM4E (1.00) KDM4EKDM6BTET3KDM4AKDM4B
SCHEMBL17670544 0.81 KDM4E (1.00) KDM4EKDM6BTET3KDM4AKDM4B
SCHEMBL20214000 0.81 KDM4E (1.00) KDM4EKDM6BTET3KDM4AKDM4B
SCHEMBL17670545 0.81 KDM4E (1.00) KDM4EKDM6BTET3KDM4AKDM4B
SCHEMBL29382353 0.81 KDM4E (1.00) KDM4EKDM6BTET3KDM4AKDM4B
SCHEMBL20101025 0.81 KMT2A (0.64) KDM4EKMT2AGAASMN1; SMN2MAPT

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
WO-2024189607-A1 METHODS AND BIOAVAILABLE HIGHLY PERMEABLE COMPOUNDS FOR DISEASES TREATMENT DIDENKO KIRILL (MX) 2024-09-19 WO disclosed