SCHEMBL10508352

SCHEMBL10508352

CCOC(=O)CCc1cccc(C(=O)c2ccc(C)cc2)c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.49
CYP4A11 Q02928 3/20 0.49
L3MBTL1 Q9Y468 3/20 0.46
MAPT P10636 3/20 0.46
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 1/20 0.46
F2 P00734 1/20 0.46
F10 P00742 1/20 0.46
LMNA P02545 2/20 0.45
TDP1 Q9NUW8 2/20 0.43
RAB9A P51151 1/20 0.43
SYK P43405 1/20 0.43
PTGS2 P35354 1/20 0.43
GAA P10253 1/20 0.42

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
SCHEMBL9444564 0.86 CYP4F2 (0.63) CYP4F2CYP4A11MAPTALDH1A1RAB9A
SCHEMBL2571306 0.83 CYP4F2 (0.54) CYP4F2CYP4A11L3MBTL1MAPTALDH1A1
SCHEMBL31455578 0.83 CYP4F2 (0.54) CYP4F2CYP4A11L3MBTL1MAPTALDH1A1
SCHEMBL4339720 0.83 CYP4F2 (0.54) CYP4F2CYP4A11L3MBTL1MAPTALDH1A1
SCHEMBL4425984 0.82 CYP4F2 (0.64) CYP4F2CYP4A11ALDH1A1TDP1SYK
SCHEMBL879289 0.81 CYP4F2 (0.58) CYP4F2CYP4A11L3MBTL1TDP1RAB9A
SCHEMBL30540945 0.81 FFAR1 (0.55) CYP4F2CYP4A11TDP1SYK
Ethyl Propionate SCHEMBL8595998 0.78 F10 (0.44) CYP4F2CYP4A11L3MBTL1MAPTALDH1A1
SCHEMBL13104077 0.78 CYP4F2 (0.58) CYP4F2CYP4A11L3MBTL1MAPTALDH1A1
SCHEMBL363982 0.77 CYP4F2 (0.77) CYP4F2CYP4A11L3MBTL1MAPTALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0085959-B1 AROMATIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1989-04-19 EP disclosed
EP-0249950-A1 Aromatic compounds THE WELLCOME FOUNDATION LIMITED (GB) 1987-12-23 EP disclosed
US-4564685-A ANTIHISTAMINES BURROUGHS WELLCOME CO., A CORP OF NC. 1986-01-14 US disclosed
EP-0085959-A2 Aromatic compounds THE WELLCOME FOUNDATION LIMITED (GB) 1983-08-17 EP disclosed