SCHEMBL11817894

SCHEMBL11817894

CCCCN(CCCC)S(=O)(=O)c1ccc(SCc2cccc(C)c2)c(C(=O)O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TAS2R14 Q9NYV8 1/20 0.47
▸ ALDH1A1 P00352 4/20 0.45
▸ MAPT P10636 2/20 0.45
▸ HPGD P15428 1/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ CNR2 P34972 2/20 0.42
▸ TP53 P04637 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.41
▸ CA2 P00918 3/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ CA4 P22748 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ CA12 O43570 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ SLC22A6 Q4U2R8 1/20 0.39
▸ SLC22A8 Q8TCC7 1/20 0.39
▸ ABCC2 Q92887 1/20 0.39

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
SCHEMBL11819921 0.96 CNR2 (0.48) TAS2R14ALDH1A1MAPTHPGDALOX15
SCHEMBL11820805 0.91 CA2 (0.48) TAS2R14ALDH1A1MAPTTP53RXFP1
SCHEMBL11819918 0.89 KMT2A (0.47) TAS2R14ALDH1A1MAPTTP53RXFP1
SCHEMBL11826205 0.89 PTPRC (0.47) TAS2R14ALDH1A1MAPTTP53RXFP1
SCHEMBL11822163 0.86 CA2 (0.47) TAS2R14ALDH1A1MAPTCNR2TP53
SCHEMBL11818580 0.86 CA2 (0.47) TAS2R14ALDH1A1MAPTCNR2TP53
SCHEMBL11817200 0.86 ALDH1A1 (0.53) TAS2R14ALDH1A1HPGDALOX15HSD17B10
SCHEMBL11820442 0.85 PTPRC (0.46) TAS2R14CNR2CA2LMNACA12
SCHEMBL11825369 0.85 KMT2A (0.45) ALDH1A1MAPTCNR2TP53RXFP1
SCHEMBL11821805 0.85 KMT2A (0.45) ALDH1A1MAPTCNR2TP53RXFP1

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
US-3954994-A Intermediates for preparing hipolipemic agents and method of lowering the blood lipid level in mammals with said agents PFIZER INC. (US) 1976-05-04 — — US disclosed
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