SCHEMBL11796137

SCHEMBL11796137

CCCCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)c1ccccc1

nearest known ligand 0.75

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GRIA1 P42261 8/20 0.75
▸ CTSL P07711 1/20 0.68
▸ L3MBTL1 Q9Y468 1/20 0.63
▸ CHRND Q07001 6/20 0.60
▸ CHRNA1 P02708 2/20 0.60
▸ CHRNG P07510 2/20 0.60
▸ CHRNB1 P11230 2/20 0.60
▸ PLG P00747 1/20 0.58
▸ PLAU P00749 1/20 0.58
▸ PRSS1 P07477 1/20 0.58
▸ PRSS2 P07478 1/20 0.58
▸ PRSS3 P35030 1/20 0.58

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
SCHEMBL10543878 0.95 GRIA1 (0.71) GRIA1CTSLL3MBTL1CHRNDCHRNA1
SCHEMBL10543883 0.95 GRIA1 (0.71) GRIA1CTSLL3MBTL1CHRNDCHRNA1
SCHEMBL11776777 0.91 L3MBTL1 (0.76) GRIA1CTSLL3MBTL1CHRNDCHRNA1
SCHEMBL4651392 0.87 GRIA1 (0.73) GRIA1CTSLL3MBTL1CHRNDCHRNA1
SCHEMBL11775228 0.86 GRIA1 (0.57) GRIA1CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL11772567 0.86 CTSL (0.77) GRIA1CTSLL3MBTL1
SCHEMBL22372487 0.84 CHRND (0.59) GRIA1CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL11778440 0.84 CHRND (0.57) GRIA1CTSLL3MBTL1CHRNDCHRNA1
SCHEMBL506060 0.83 NAAA (0.65) GRIA1L3MBTL1
SCHEMBL506059 0.83 NAAA (0.65) GRIA1L3MBTL1

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-4004008-A ANTISPASMODIC, VASODILATION ROTTA RESEARCH LABORATORIUM S.P.A. (IT) 1977-01-18 — — US disclosed
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