SCHEMBL9575941

SCHEMBL9575941

CCCCCCCCCCCCCCCCCCOC[C@@H](O)COC(=O)CCCCl

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.57
DUSP3 P51452 1/20 0.57
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
LMNA P02545 1/20 0.57
LPAR1 Q92633 6/20 0.55
ENPP2 Q13822 5/20 0.55
LPAR5 Q9H1C0 4/20 0.55
LPAR4 Q99677 3/20 0.55
LPAR2 Q9HBW0 3/20 0.55
LPAR3 Q9UBY5 3/20 0.55
LPAR6 P43657 2/20 0.55
MAPT P10636 1/20 0.53
USP2 O75604 1/20 0.51
HTT P42858 1/20 0.50
DGKA P23743 1/20 0.50
TRPV1 Q8NER1 2/20 0.48
CES2 O00748 1/20 0.48

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
SCHEMBL19241181 0.91 LMNA (0.69) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL25229650 0.91 LMNA (0.69) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL10477783 0.91 LMNA (0.69) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL23042348 0.91 LMNA (0.69) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL27166293 0.91 LMNA (0.69) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL16236223 0.90 LMNA (0.66) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL15096661 0.88 LMNA (0.69) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL6368636 0.88 KDM4E (0.59) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL12554987 0.88 LMNA (0.69) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL12554333 0.88 LMNA (0.69) KDM4EDUSP3MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5187293-A Blood platelet activating factor inhibitors HOFFMANN-LA ROCHE INC. (US) 1993-02-16 US disclosed
US-4731373-A BLOOD PLATELET ACTIVATING FACTOR HOFFMAN-LA ROCHE INC. (US) 1988-03-15 US disclosed
EP-0147768-A2 Glycerin derivatives F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1985-07-10 EP disclosed