SCHEMBL11832270

SCHEMBL11832270

CC(=O)SC(CC(N)=O)Cc1ccc(-c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRR Q9GZT4 2/20 0.46
▸ PSAT1 Q9Y617 2/20 0.46
▸ ACACB O00763 1/20 0.42
▸ FFAR1 O14842 1/20 0.41
▸ PPARG P37231 6/20 0.41
▸ PPARA Q07869 5/20 0.41
▸ MME P08473 3/20 0.41
▸ ACE P12821 3/20 0.41
▸ ACE2 Q9BYF1 2/20 0.41
▸ CPA1 P15085 1/20 0.41
▸ MMP12 P39900 1/20 0.40
▸ ABCC4 O15439 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ PTGS1 P23219 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ MC4R P32245 1/20 0.40
▸ MC5R P33032 1/20 0.40
▸ MC3R P41968 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
SCHEMBL11834777 0.88 MMP12 (0.48) SRRPSAT1ACACBFFAR1PPARG
SCHEMBL11826818 0.83 ALDH1A1 (0.43) SRRPSAT1ACACBFFAR1PPARG
SCHEMBL11828803 0.83 SRR (0.43) SRRPSAT1ACACBPPARGPPARA
SCHEMBL11827301 0.81 SRR (0.45) SRRPSAT1PPARGPPARAMME
SCHEMBL11821169 0.80 PPARA (0.49) SRRPSAT1PPARGPPARA
SCHEMBL11829367 0.79 SRR (0.51) SRRPSAT1FFAR1PPARGPPARA
SCHEMBL10187475 0.79 SRR (0.41) SRRPSAT1ACACBFFAR1PPARG
SCHEMBL6155924 0.79 CPA1 (0.51) CPA1TSHRPTGS1
SCHEMBL11827473 0.78 NAAA (0.52) LMNAGAATSHRDPP4
SCHEMBL11827807 0.78 KMT2A (0.52) MMEACEACE2CPA1HTT

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-3966801-A ANTIINFLAMMATORY AGENTS WILLIAM H. RORER, INC. (US) 1976-06-29 — — US disclosed
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