SCHEMBL31028666

SCHEMBL31028666

Nc1cc(Br)c(F)cc1CO

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 8/20 0.36
KDM1B Q8NB78 5/20 0.36
KCNH2 Q12809 4/20 0.36
ALDH1A1 P00352 2/20 0.32
ADRB2 P07550 3/20 0.32
CYP1A2 P05177 1/20 0.30
ALOX15 P16050 1/20 0.30
CASP7 P55210 1/20 0.30
HIF1A Q16665 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL17466051 0.92 KDM1A (0.32) KDM1AKDM1BKCNH2ALDH1A1ADRB2
SCHEMBL30707419 0.92 KDM1A (0.32) KDM1AKDM1BKCNH2ALDH1A1ADRB2
SCHEMBL23535233 0.84 KDM1A (0.38) KDM1AKDM1BKCNH2ALDH1A1ADRB2
SCHEMBL24697715 0.82 KDM1A (0.36) KDM1AKDM1BKCNH2CYP1A2
SCHEMBL15713827 0.82 POLB (0.38) ALDH1A1CYP1A2ALOX15CASP7HIF1A
SCHEMBL31070286 0.82 DPP4 (0.33) ALDH1A1CYP1A2ALOX15CASP7HIF1A
SCHEMBL2209800 0.82 DPP4 (0.33) ALDH1A1CYP1A2ALOX15CASP7HIF1A
SCHEMBL856379 0.80 KDM1A (0.39) KDM1AKDM1BKCNH2CYP1A2
SCHEMBL1773032 0.78 PTPN1 (0.37) KDM1AKDM1BKCNH2ALOX15
SCHEMBL30574768 0.78 PTPN1 (0.37) KDM1AKDM1BKCNH2ALOX15

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4662206-A1 GSPT1 DEGRADER COMPOUNDS Captor Therapeutics S.A. (PL) 2025-12-17 EP disclosed
WO-2025072330-A1 KIT INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARCUS BIOSCIENCES, INC. (US) 2025-04-03 WO disclosed
WO-2024165577-A1 GSPT1 DEGRADER COMPOUNDS CAPTOR THERAPEUTICS S.A. (PL) 2024-08-15 WO disclosed