SCHEMBL8042356

SCHEMBL8042356

Cc1ccc(CSc2nc(-c3ccccn3)nnc2-c2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.50
MAPT P10636 1/20 0.47
METAP1 P53582 1/20 0.46
OPRK1 P41145 3/20 0.44
RAB9A P51151 1/20 0.44
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HCRTR1 O43613 1/20 0.41
GRM5 P41594 1/20 0.40
KDM4E B2RXH2 2/20 0.40
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HTT P42858 1/20 0.40
MITF O75030 1/20 0.40

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 0.92 METAP1 (0.49) HIF1AMAPTMETAP1OPRK1RAB9A
SCHEMBL8041617 0.90 MAPT (0.47) HIF1AMAPTMETAP1OPRK1RAB9A
SCHEMBL8032085 0.89 HIF1A (0.52) HIF1AMAPTMETAP1OPRK1RAB9A
SCHEMBL8032107 0.85 HIF1A (0.45) HIF1AGRM5KDM4ELMNASMN1; SMN2
SCHEMBL8041606 0.83 HIF1A (0.51) HIF1AMAPTMETAP1GRM5KDM4E
SCHEMBL8043507 0.83 NPC1 (0.43) HIF1AMAPTRAB9AALDH1A1L3MBTL1
SCHEMBL8045505 0.81 HIF1A (0.45) HIF1AMETAP1GRM5KDM4ELMNA
SCHEMBL8049571 0.81 OPRK1 (0.49) HIF1AMAPTOPRK1RAB9AMEN1
SCHEMBL8041620 0.81 HIF1A (0.48) HIF1AMETAP1GRM5KDM4ELMNA
SCHEMBL8043588 0.81 HIF1A (0.43) HIF1AMAPTMETAP1RAB9AALDH1A1

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