SCHEMBL11836244

SCHEMBL11836244

CC(C(=O)O)C(Cl)Cc1ccc(-c2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 10/20 0.52
▸ ACE P12821 10/20 0.52
▸ ACE2 Q9BYF1 4/20 0.52
▸ CPA1 P15085 3/20 0.52
▸ SRR Q9GZT4 2/20 0.51
▸ PSAT1 Q9Y617 2/20 0.51
▸ PPARG P37231 6/20 0.50
▸ PPARA Q07869 5/20 0.50
▸ ABCC4 O15439 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ GAA P10253 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ PTGS1 P23219 1/20 0.50
▸ HTT P42858 1/20 0.50

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
SCHEMBL11826313 0.80 MME (0.52) MMEACEACE2CPA1SRR
SCHEMBL16948243 0.79 MME (0.63) MMEACEACE2CPA1SRR
SCHEMBL7507834 0.79 MME (0.63) MMEACEACE2CPA1SRR
SCHEMBL4020585 0.79 MME (0.63) MMEACEACE2CPA1SRR
SCHEMBL1764568 0.76 SRR (0.62) MMEACEACE2CPA1SRR
Benzene SCHEMBL27761112 0.75 SLC7A5 (0.70) MMEACEACE2SRRPSAT1
SCHEMBL12258523 0.74 MME (0.54) MMEACEACE2CPA1SRR
SCHEMBL10065875 0.74 MME (0.62) MMEACEACE2CPA1SRR
SCHEMBL12258522 0.74 MME (0.54) MMEACEACE2CPA1SRR
SCHEMBL12258520 0.74 MME (0.54) MMEACEACE2CPA1SRR

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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