SCHEMBL8043507

SCHEMBL8043507

Fc1ccccc1CSc1nc(-c2ccccn2)nnc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.43
RAB9A P51151 4/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
ALDH1A1 P00352 2/20 0.43
GRM5 P41594 1/20 0.41
HTT P42858 2/20 0.40
HIF1A Q16665 7/20 0.40
TOP2A P11388 1/20 0.40
MAPT P10636 2/20 0.39
KDM4E B2RXH2 2/20 0.38
LMNA P02545 2/20 0.38
MITF O75030 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
PKM P14618 1/20 0.38

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
SCHEMBL8043531 0.86 METAP1 (0.49) NPC1RAB9ASMN1; SMN2GRM5HTT
SCHEMBL8032107 0.84 HIF1A (0.45) SMN1; SMN2GRM5HTTHIF1AKDM4E
SCHEMBL8042356 0.83 HIF1A (0.50) RAB9ASMN1; SMN2L3MBTL1ALDH1A1GRM5
SCHEMBL8041617 0.83 MAPT (0.47) NPC1RAB9ASMN1; SMN2L3MBTL1GRM5
SCHEMBL8045505 0.82 HIF1A (0.45) SMN1; SMN2GRM5HTTHIF1AKDM4E
SCHEMBL8041606 0.82 HIF1A (0.51) SMN1; SMN2GRM5HTTHIF1AMAPT
SCHEMBL8049571 0.82 OPRK1 (0.49) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL8043609 0.81 HIF1A (0.47) NPC1RAB9ASMN1; SMN2ALDH1A1GRM5
SCHEMBL8032085 0.81 HIF1A (0.52) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL8043558 0.80 TRPV1 (0.46) RAB9ASMN1; SMN2ALDH1A1GRM5HTT

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