SCHEMBL11819918

SCHEMBL11819918

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ HTT P42858 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.40
▸ TP53 P04637 2/20 0.40
▸ CA2 P00918 4/20 0.39
▸ CA12 O43570 3/20 0.39
▸ CA9 Q16790 3/20 0.39
▸ CA4 P22748 2/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA6 P23280 1/20 0.39
▸ CA5A P35218 1/20 0.39
▸ CA7 P43166 1/20 0.39
▸ CA13 Q8N1Q1 1/20 0.39
▸ CA14 Q9ULX7 1/20 0.39
▸ CA5B Q9Y2D0 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ POLB P06746 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
SCHEMBL11821805 0.96 KMT2A (0.45) KMT2AMEN1HTTALDH1A1MAPT
SCHEMBL11825369 0.96 KMT2A (0.45) KMT2AMEN1HTTALDH1A1MAPT
SCHEMBL11820805 0.90 CA2 (0.48) KMT2AMEN1ALDH1A1MAPTRXFP1
SCHEMBL11817894 0.89 TAS2R14 (0.47) KMT2AMEN1ALDH1A1MAPTRXFP1
SCHEMBL11818861 0.88 KMT2A (0.45) KMT2AMEN1HTTALDH1A1MAPT
SCHEMBL11825334 0.88 KMT2A (0.43) KMT2AMEN1HTTALDH1A1RXFP1
SCHEMBL11826205 0.88 PTPRC (0.47) KMT2AMEN1ALDH1A1MAPTRXFP1
SCHEMBL11820863 0.86 KMT2A (0.48) KMT2AMEN1HTTALDH1A1TP53
SCHEMBL11822163 0.85 CA2 (0.47) KMT2AMEN1ALDH1A1MAPTRXFP1
SCHEMBL11818580 0.85 CA2 (0.47) KMT2AMEN1ALDH1A1MAPTRXFP1

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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