SCHEMBL11819833

SCHEMBL11819833

O=C(O)c1cc(Br)cc(SCc2cccc(Br)c2)c1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.52
▸ MEN1 O00255 2/20 0.52
▸ HTT P42858 2/20 0.47
▸ MAPT P10636 2/20 0.47
▸ MRGPRX4 Q96LA9 2/20 0.44
▸ PTGDR2 Q9Y5Y4 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ AR P10275 1/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ MAOB P27338 1/20 0.41
▸ APEX1 P27695 1/20 0.41
▸ USP2 O75604 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ HCAR2 Q8TDS4 1/20 0.40

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
SCHEMBL11820801 0.81 NPC1 (0.45) KMT2AMEN1HTTMAPTMRGPRX4
SCHEMBL11816320 0.80 MEN1 (0.49) KMT2AMEN1MAPTMRGPRX4SMN1; SMN2
SCHEMBL11819309 0.79 ALDH1A1 (0.43) KMT2AMEN1HTTMAPTPTGDR2
SCHEMBL11816193 0.79 KMT2A (0.44) KMT2AMEN1HTTMAPTSMN1; SMN2
SCHEMBL11819838 0.77 MRGPRX4 (0.52) KMT2AMEN1MAPTMRGPRX4RAB9A
SCHEMBL16143105 0.76 HTT (0.54) KMT2AMEN1HTTMAPTPTGDR2
SCHEMBL11815274 0.76 MRGPRX4 (0.53) KMT2AMEN1HTTMAPTMRGPRX4
SCHEMBL12581571 0.75 APEX1 (0.65) HTTMAPTMRGPRX4SMN1; SMN2AR
SCHEMBL23012753 0.75 PTGDR2 (0.51) KMT2AMEN1HTTMAPTPTGDR2
SCHEMBL29691413 0.75 PTGDR2 (0.51) KMT2AMEN1HTTMAPTPTGDR2

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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