SCHEMBL8043609

SCHEMBL8043609

C=CCSc1nc(-c2ccccn2)nnc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 11/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
KDM4E B2RXH2 3/20 0.47
LMNA P02545 3/20 0.47
HTT P42858 2/20 0.47
GRM5 P41594 1/20 0.42
ALDH1A1 P00352 1/20 0.40
MITF O75030 1/20 0.40
TRPV1 Q8NER1 1/20 0.39
NPC1 O15118 1/20 0.37
MAPK1 P28482 1/20 0.37
RAB9A P51151 1/20 0.37
F2 P00734 1/20 0.37
F12 P00748 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL8032107 0.86 HIF1A (0.45) HIF1ASMN1; SMN2KDM4ELMNAHTT
SCHEMBL8041606 0.84 HIF1A (0.51) HIF1ASMN1; SMN2KDM4ELMNAHTT
SCHEMBL8043531 0.84 METAP1 (0.49) HIF1ASMN1; SMN2KDM4ELMNAHTT
SCHEMBL8045505 0.84 HIF1A (0.45) HIF1ASMN1; SMN2KDM4ELMNAHTT
SCHEMBL8043558 0.82 TRPV1 (0.46) HIF1ASMN1; SMN2KDM4ELMNAHTT
SCHEMBL8041620 0.81 HIF1A (0.48) HIF1ASMN1; SMN2KDM4ELMNAHTT
SCHEMBL8043588 0.81 HIF1A (0.43) HIF1ASMN1; SMN2KDM4ELMNAHTT
SCHEMBL8043507 0.81 NPC1 (0.43) HIF1ASMN1; SMN2KDM4ELMNAHTT
SCHEMBL8042356 0.81 HIF1A (0.50) HIF1ASMN1; SMN2KDM4ELMNAHTT
SCHEMBL8041617 0.81 MAPT (0.47) HIF1ASMN1; SMN2LMNAHTTGRM5

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