SCHEMBL7478874

SCHEMBL7478874

O=C(O)c1cccc(C=Cc2nc(-c3ccccc3)cs2)c1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.52
TTR P02766 3/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
KDM4E B2RXH2 2/20 0.49
PARP1 P09874 1/20 0.46
CSNK2A1 P68400 2/20 0.45
HDAC4 P56524 1/20 0.44
MEF2D Q14814 1/20 0.44
MAPT P10636 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
UNG P13051 1/20 0.44
FBP1 P09467 1/20 0.44
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
PHGDH O43175 1/20 0.43

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
SCHEMBL7478870 1.00 NR1H4 (0.52) NR1H4TTRNPC1RAB9ASMN1; SMN2
SCHEMBL17336959 0.91 KMO (0.51) NR1H4TTRNPC1RAB9ASMN1; SMN2
SCHEMBL17336957 0.91 KMO (0.51) NR1H4TTRNPC1RAB9ASMN1; SMN2
SCHEMBL9514548 0.83 ALOX5 (0.51) NPC1RAB9ASMN1; SMN2KDM4EPARP1
SCHEMBL9514540 0.83 ALOX5 (0.51) NPC1RAB9ASMN1; SMN2KDM4EPARP1
SCHEMBL9514841 0.80 CYP19A1 (0.54) NPC1RAB9ASMN1; SMN2KDM4EPARP1
SCHEMBL5777558 0.80 CYP19A1 (0.54) NPC1RAB9ASMN1; SMN2KDM4EPARP1
SCHEMBL9514907 0.80 ALB (0.48) NR1H4NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL7466164 0.79 TTR (0.48) TTRNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL7466155 0.79 TTR (0.48) TTRNPC1RAB9ASMN1; SMN2KDM4E

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-0786457-B1 AZOLE DERIVATIVES YAMANOUCHI PHARMA CO LTD (JP) 2002-05-29 EP disclosed
US-5981559-A USEFUL IN PREVENTING OR TREATING ALLERGIC DISEASES, ISCHEMIC HEART DISEASES OR ISCHEMIC BRAIN DISEASES YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1999-11-09 US disclosed
EP-0786457-A1 AZOLE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1997-07-30 EP disclosed