SCHEMBL11820801

SCHEMBL11820801

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

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ TNF P01375 1/20 0.45
▸ NOD1 Q9Y239 1/20 0.45
▸ MEN1 O00255 5/20 0.43
▸ KMT2A Q03164 5/20 0.43
▸ ALDH1A1 P00352 6/20 0.42
▸ TP53 P04637 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ HTT P42858 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ TSHR P16473 2/20 0.39
▸ HPGD P15428 3/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MRGPRX4 Q96LA9 1/20 0.39
▸ USP2 O75604 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ LMNA P02545 1/20 0.38

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
SCHEMBL11822961 0.88 ALDH1A1 (0.49) NPC1RAB9ATNFNOD1MEN1
SCHEMBL11819309 0.87 ALDH1A1 (0.43) MEN1KMT2AALDH1A1HTTMAPT
SCHEMBL11816193 0.86 KMT2A (0.44) RAB9AMEN1KMT2ATP53SMN1; SMN2
SCHEMBL11827713 0.85 KMT2A (0.43) RAB9AMEN1KMT2ASMN1; SMN2HTT
SCHEMBL11822223 0.83 MEN1 (0.46) NPC1RAB9ATNFNOD1MEN1
SCHEMBL11814493 0.81 ALDH1A1 (0.49) NPC1RAB9ATNFNOD1MEN1
SCHEMBL11819833 0.81 KMT2A (0.52) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL11853927 0.78 TRPV4 (0.45) RAB9AMEN1KMT2AALDH1A1HPGD
SCHEMBL11820863 0.78 KMT2A (0.48) NPC1RAB9ATNFNOD1MEN1
SCHEMBL11819988 0.75 LMNA (0.46) MEN1KMT2AALDH1A1TSHRHPGD

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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