SCHEMBL27508207

SCHEMBL27508207

CCCCCCCCCCCCCCCCC=COC(=O)C(C)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.47
FAAH O00519 2/20 0.45
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 3/20 0.45
F7 P08709 3/20 0.45
F3 P13726 3/20 0.45
PPARG P37231 2/20 0.45
PPARD Q03181 2/20 0.45
PPARA Q07869 2/20 0.45
DUSP3 P51452 1/20 0.45
PTPN7 P35236 1/20 0.45
FFAR1 O14842 1/20 0.45
LMNA P02545 1/20 0.45
FABP3 P05413 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP19A1 P11511 1/20 0.45
FABP4 P15090 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45

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
SCHEMBL3019481 1.00 DGKA (0.47) DGKAFAAHALDH1A1KDM4EF7
SCHEMBL3019478 1.00 DGKA (0.47) DGKAFAAHALDH1A1KDM4EF7
SCHEMBL3018326 0.93 FAAH (0.40) DGKAFAAHF7F3PPARG
SCHEMBL3018328 0.93 FAAH (0.40) DGKAFAAHF7F3PPARG
SCHEMBL28565888 0.93 FAAH (0.40) DGKAFAAHF7F3PPARG
SCHEMBL8672006 0.87 CA1 (0.44) FAAH
SCHEMBL4965109 0.86 PPARG (0.44) ALDH1A1KDM4EF7F3PPARG
SCHEMBL25213498 0.85 KDM4E (0.47) FAAHALDH1A1KDM4EF7F3
SCHEMBL30964204 0.85 KDM4E (0.47) FAAHALDH1A1KDM4EF7F3
SCHEMBL28433676 0.85 KDM4E (0.47) FAAHALDH1A1KDM4EF7F3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1174037-C Gel composition �����ɺϻ﹫˾ 2004-11-03 CN disclosed
CN-1134418-C Substituted pyrazolyl benzenesulfonamides for treating inflammation - 2004-01-14 CN disclosed