SCHEMBL8043537

SCHEMBL8043537

FC(F)(F)c1ccc(CNc2nc(-c3ccccn3)nnc2-c2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 19/20 0.77
KDM4E B2RXH2 2/20 0.55
LMNA P02545 2/20 0.55
HTT P42858 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55

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
SCHEMBL8049591 0.97 HIF1A (0.72) HIF1AKDM4ELMNAHTTSMN1; SMN2
SCHEMBL8042397 0.97 HIF1A (0.79) HIF1AKDM4ELMNAHTTSMN1; SMN2
SCHEMBL8042372 0.96 HIF1A (0.71) HIF1AKDM4ELMNAHTTSMN1; SMN2
SCHEMBL8032090 0.92 HIF1A (0.68) HIF1AKDM4ELMNAHTTSMN1; SMN2
SCHEMBL8045572 0.92 HIF1A (0.80) HIF1AKDM4ELMNAHTTSMN1; SMN2
SCHEMBL8045493 0.91 HIF1A (0.64) HIF1AKDM4ELMNAHTTSMN1; SMN2
SCHEMBL8032069 0.90 HIF1A (0.77) HIF1AKDM4ELMNAHTTSMN1; SMN2
SCHEMBL8045488 0.90 HIF1A (0.79) HIF1AKDM4ELMNAHTTSMN1; SMN2
SCHEMBL29546979 0.87 HIF1A (1.00) HIF1AKDM4ELMNAHTTSMN1; SMN2
SCHEMBL19911080 0.87 HIF1A (1.00) HIF1AKDM4ELMNAHTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6159974-A LDL receptor gene expression promoters SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2000-12-12 US claimed
US-6159974-A LDL receptor gene expression promoters SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2000-12-12 US disclosed