SCHEMBL20780312

SCHEMBL20780312

CCN(Cc1cccc(C(=O)O)c1)C(=O)OC

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEP1B Q16820 11/20 0.51
▸ MEP1A Q16819 3/20 0.51
▸ PPARG P37231 1/20 0.51
▸ MRGPRX4 Q96LA9 5/20 0.48
▸ TP53 P04637 2/20 0.48
▸ PKM P14618 2/20 0.48
▸ NFKB1 P19838 2/20 0.48
▸ NFKB2 Q00653 2/20 0.48
▸ RELA Q04206 2/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ RXFP1 Q9HBX9 1/20 0.48
▸ FOLH1 Q04609 1/20 0.47
▸ LMNA P02545 1/20 0.46

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
SCHEMBL15762363 0.83 LMNA (0.66) LMNA
SCHEMBL20794226 0.82 MEP1B (0.54) MEP1BMEP1AMRGPRX4TP53PKM
SCHEMBL13180006 0.82 HSD17B2 (0.47) LMNA
SCHEMBL4407864 0.80 MEP1B (0.65) MEP1BMEP1AMRGPRX4TP53PKM
SCHEMBL13227044 0.79 MEP1B (0.50) MEP1BMEP1AMRGPRX4TP53PKM
SCHEMBL15142867 0.77 FOLH1 (0.54) MEP1BMEP1APPARGMRGPRX4TP53
SCHEMBL29630981 0.75 FOLH1 (0.59) MEP1BMEP1AMRGPRX4TP53PKM
SCHEMBL168738 0.75 FOLH1 (0.59) MEP1BMEP1AMRGPRX4TP53PKM
SCHEMBL4018145 0.74 LMNA (0.56) RAB9ALMNA
Hydrochloric Acid SCHEMBL29690742 0.73 FOLH1 (0.58) MEP1BMEP1AMRGPRX4TP53PKM

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
WO-2019043018-A1 METHODS FOR TREATING OR PREVENTING CARDIOVASCULAR DISORDERS AND LOWERING RISK OF CARDIOVASCULAR EVENTS DALCOR PHARMA UK LTD., STOCKPORT ZUG BRANCH (CH) 2019-03-07 — — WO disclosed
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