SCHEMBL11817067

SCHEMBL11817067

O=C(O)c1cc(S(=O)(=O)N2CCCCCCCCCCCC2)ccc1SCc1ccc(Br)cc1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.58
▸ TSHR P16473 2/20 0.55
▸ CYP3A4 P08684 1/20 0.54
▸ ALDH1A1 P00352 2/20 0.53
▸ MAPT P10636 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ L3MBTL1 Q9Y468 3/20 0.47
▸ PKM P14618 1/20 0.46
▸ TP53 P04637 1/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ CTDSP1 Q9GZU7 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL11815191 0.88 TSHR (0.53) HSD17B10TSHRCYP3A4ALDH1A1MAPT
SCHEMBL11817298 0.86 TDP1 (0.58) HSD17B10TSHRCYP3A4ALDH1A1MAPT
SCHEMBL11817881 0.82 L3MBTL1 (0.59) HSD17B10TSHRCYP3A4ALDH1A1MAPT
SCHEMBL11818707 0.80 CYP3A4 (0.62) HSD17B10TSHRCYP3A4MAPTL3MBTL1
SCHEMBL11817749 0.77 PTPRG (0.44) ALDH1A1MEN1KMT2A
SCHEMBL11821935 0.74 L3MBTL1 (0.60) HSD17B10TSHRCYP3A4ALDH1A1MAPT
SCHEMBL1000486 0.72 POLB (0.74) HSD17B10TSHRCYP3A4ALDH1A1MAPT
SCHEMBL1708867 0.72 TSHR (1.00) HSD17B10TSHRCYP3A4ALDH1A1MAPT
SCHEMBL11819446 0.71 CYP3A4 (0.59) HSD17B10TSHRCYP3A4MAPTL3MBTL1
SCHEMBL11822430 0.71 ALDH1A1 (0.54) CYP3A4ALDH1A1MAPTHTTTP53

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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