SCHEMBL10686283

SCHEMBL10686283

CCCCCCCCCCCCCCCCOCC(CO)COC(C)=O

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.53
PLA2G2C Q5R387 6/20 0.48
CES2 O00748 1/20 0.47
ALDH1A1 P00352 1/20 0.44
PRKCA P17252 3/20 0.44
HTT P42858 2/20 0.44
LPAR5 Q9H1C0 1/20 0.42
MEN1 O00255 1/20 0.42
THRB P10828 1/20 0.42
KMT2A Q03164 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
SCHEMBL20898306 0.86 USP2 (0.68) USP2PLA2G2CCES2PRKCAHTT
SCHEMBL27636164 0.84 ALDH1A1 (0.57) USP2PLA2G2CCES2ALDH1A1HTT
SCHEMBL20898182 0.84 USP2 (0.64) USP2PLA2G2CHTTLPAR5MEN1
SCHEMBL22287251 0.83 USP2 (0.63) USP2PLA2G2CCES2PRKCAHTT
SCHEMBL21046030 0.82 USP2 (0.68) USP2PLA2G2CCES2PRKCAHTT
SCHEMBL21046040 0.82 USP2 (0.68) USP2PLA2G2CCES2PRKCAHTT
SCHEMBL21046008 0.82 USP2 (0.68) USP2PLA2G2CCES2PRKCAHTT
SCHEMBL16367888 0.82 USP2 (0.68) USP2PLA2G2CCES2PRKCAHTT
SCHEMBL21046022 0.82 USP2 (0.68) USP2PLA2G2CCES2PRKCAHTT
SCHEMBL21046018 0.82 USP2 (0.68) USP2PLA2G2CCES2PRKCAHTT

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
US-4761404-A RESPIRATORY SYSTEM DISORDERS, ANTIPYRETICS, ANALGESICS MERCK & CO., INC. (US) 1988-08-02 US disclosed
EP-0208961-A2 Phospholipid analogs useful as paf synthesis inhibitors MERCK & CO. INC. (US) 1987-01-21 EP disclosed