SCHEMBL8529116

SCHEMBL8529116

Fc1c(Cl)cc(Br)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.35
KDM1B Q8NB78 2/20 0.35
AHR P35869 3/20 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
SCHEMBL30753560 0.81 KDM1A (0.34) KDM1AKDM1BAHR
SCHEMBL23673189 0.81 KDM1A (0.34) KDM1AKDM1BAHR
SCHEMBL14956862 0.81 KDM1A (0.34) KDM1AKDM1BAHR
SCHEMBL8528070 0.78 CYP3A4 (0.41) AHR
SCHEMBL31110619 0.78 CA1 (0.32) KDM1AKDM1BAHR
SCHEMBL31302156 0.77 HSD17B10 (0.36) KDM1AKDM1BAHR
SCHEMBL17649240 0.77 CA1 (0.41) KDM1AKDM1BAHR
SCHEMBL18302718 0.76 GAA (0.32) KDM1AKDM1BAHR
SCHEMBL14247166 0.76 NMT1 (0.38) KDM1AKDM1BAHR
SCHEMBL30543313 0.76 GAA (0.32) KDM1AKDM1BAHR

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-0682008-B1 Substituted 2-chloro-3,4,5-trifluorobenzenes and process for their preparation CLARIANT GMBH (DE) 1998-12-30 EP disclosed
US-5565612-A Substituted 2-chloro-3,4,5-trifluorobenzenes and a process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1996-10-15 US disclosed
EP-0682008-A1 Substituted 2-chloro-3,4,5-trifluorobenzenes and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1995-11-15 EP disclosed