SCHEMBL31413620

SCHEMBL31413620

[O-][S+]1Cc2cc(F)c(Br)cc2C1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 6/20 0.33
KDM1B Q8NB78 4/20 0.33
KCNH2 Q12809 2/20 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
SCHEMBL29547198 0.74 KDM1A (0.39) KDM1AKDM1BKCNH2
SCHEMBL21559859 0.72
SCHEMBL31607333 0.70 KDM1A (0.36) KDM1AKDM1BKCNH2
SCHEMBL18480864 0.70 KDM1A (0.36) KDM1AKDM1BKCNH2
SCHEMBL17221129 0.68 PNMT (0.36) KDM1AKDM1BKCNH2
SCHEMBL31394204 0.68 PRKCG (0.35) KDM1AKDM1BKCNH2
SCHEMBL30927820 0.68 PNMT (0.36) KDM1AKDM1BKCNH2
SCHEMBL31413676 0.68 KDM1A (0.35) KDM1AKDM1BKCNH2
SCHEMBL23073111 0.68 MEN1 (0.31) KDM1AKDM1BKCNH2
Hydrochloric Acid SCHEMBL17221679 0.67 PNMT (0.35) KDM1AKDM1BKCNH2

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-2025041076-A1 BICYCLIC COMPOUNDS AS CDK INHIBITORS BEIGENE SWITZERLAND GMBH (CH) 2025-02-27 WO disclosed