SCHEMBL24169142

SCHEMBL24169142

[N-]=[N+]=Nc1cc(Br)ccc1F

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.32
KDM1A O60341 2/20 0.31
KDM1B Q8NB78 1/20 0.31
NOX1 Q9Y5S8 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
SCHEMBL26618043 0.84 DGAT1 (0.36) DGAT1KDM1AKDM1BNOX1
SCHEMBL20263273 0.79 CA3 (0.38) KDM1AKDM1B
SCHEMBL30280670 0.79 CA3 (0.38) KDM1AKDM1B
SCHEMBL28493663 0.76 KDM4E (0.37) NOX1
SCHEMBL22914962 0.76 ESR1 (0.33)
SCHEMBL31408842 0.76
SCHEMBL30402438 0.75 ALOX15 (0.38) NOX1
SCHEMBL15897331 0.73 KDM1A (0.32) KDM1AKDM1B
SCHEMBL26915320 0.73 PDE2A (0.42)
SCHEMBL10091983 0.72 DGAT1 (0.39) DGAT1KDM1AKDM1B

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-3717471-B1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF DISEASES GALAPAGOS NV (BE) 2022-01-05 EP disclosed