SCHEMBL4726366

SCHEMBL4726366

CCC(Oc1ccc(/C(Cc2ccccc2)=N/OCCn2ccc3ccccc32)cc1C)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.39
HTT P42858 2/20 0.38
TSHR P16473 1/20 0.38
PPARA Q07869 5/20 0.38
PPARG P37231 4/20 0.38
SMN1; SMN2 Q16637 4/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
LMNA P02545 1/20 0.35
MCL1 Q07820 3/20 0.34
TRPM5 Q9NZQ8 1/20 0.34
PPARD Q03181 1/20 0.34
MAPK1 P28482 2/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL4726370 1.00 HSD17B10 (0.39) HSD17B10HTTTSHRPPARAPPARG
SCHEMBL4725557 0.91 TSHR (0.39) HTTTSHRPPARAPPARGSMN1; SMN2
SCHEMBL4725558 0.91 TSHR (0.39) HTTTSHRPPARAPPARGSMN1; SMN2
SCHEMBL4729074 0.88 HTT (0.40) HSD17B10HTTTSHRPPARAPPARG
SCHEMBL4729069 0.88 HTT (0.40) HSD17B10HTTTSHRPPARAPPARG
SCHEMBL4727908 0.86 PPARA (0.41) PPARAPPARGSMN1; SMN2ALDH1A1PPARD
SCHEMBL4727910 0.86 PPARA (0.41) PPARAPPARGSMN1; SMN2ALDH1A1PPARD
SCHEMBL4727006 0.85 MCL1 (0.43) HSD17B10HTTTSHRPPARAPPARG
SCHEMBL4727000 0.85 MCL1 (0.43) HSD17B10HTTTSHRPPARAPPARG
SCHEMBL4729739 0.83 SMN1; SMN2 (0.41) HSD17B10HTTTSHRPPARAPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008035359-A2 OXIMINOPHENOXYALKANOIC ACID AND PHENYLALKANOIC ACID DERIVATIVES CADILA HEALTHCARE LIMITED (IN) 2008-03-27 WO claimed