SCHEMBL9714567

SCHEMBL9714567

NC(=O)c1cn(C(Cl)c2ccccc2)cn1

nearest known ligand 0.66

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADA P00813 15/20 0.66
KDM5A P29375 1/20 0.36
KDM5B Q9UGL1 1/20 0.36
EPHX1 P07099 1/20 0.35

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
SCHEMBL7452471 0.79 ADA (1.00) ADA
SCHEMBL6173265 0.76 ADA (0.59) ADA
SCHEMBL7827340 0.75 ADA (0.61) ADAKDM5AKDM5B
SCHEMBL24268206 0.72 ADA (0.53) ADAKDM5A
SCHEMBL30724486 0.72 ADA (0.74) ADA
SCHEMBL7661357 0.70 ADA (0.58) ADA
Fr-221647 SCHEMBL7659103 0.70 ADA (1.00) ADA
SCHEMBL1079993 0.69 ADA (0.50) ADA
SCHEMBL29215855 0.69 KDM5A (0.59) ADAKDM5AKDM5B
SCHEMBL15964744 0.69 RBP4 (0.54) ADAKDM5AKDM5B

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-0248414-B1 ARALKYL IMIDAZOLE DERIVATIVES CIBA-GEIGY AG (CH) 1992-09-23 EP claimed