SCHEMBL6663375

SCHEMBL6663375

C=C(C(=O)OC(CC)CCCCC)C(C)O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.38
PRKCD Q05655 1/20 0.38
GPR84 Q9NQS5 7/20 0.37
CA1 P00915 2/20 0.37
FFAR1 O14842 1/20 0.37
FAAH O00519 2/20 0.36
ABCB1 P08183 1/20 0.35
LMNA P02545 2/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
CTSK P43235 1/20 0.35

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
SCHEMBL28138058 0.87 CA1 (0.41) PRKCAPRKCDCA1FFAR1FAAH
SCHEMBL6658614 0.86 FAAH (0.41) PRKCAPRKCDCA1FAAHLMNA
SCHEMBL6661368 0.86 PRKCA (0.38) PRKCAPRKCDGPR84CA1FAAH
SCHEMBL5031265 0.84 CA2 (0.42) PRKCAPRKCDGPR84CA1FFAR1
SCHEMBL154112 0.81 TSHR (0.49) PRKCAPRKCDGPR84CA1FFAR1
SCHEMBL2285455 0.81 PRKCA (0.41) PRKCAPRKCDGPR84FFAR1CTSK
SCHEMBL9152143 0.81 ACHE (0.40) PRKCAPRKCDGPR84CA1FFAR1
SCHEMBL28526610 0.80 TSHR (0.51) PRKCAPRKCDGPR84FFAR1FAAH
SCHEMBL2238972 0.80 PRKCA (0.40) PRKCAPRKCDGPR84CA1FFAR1
SCHEMBL28697418 0.80 TSHR (0.51) PRKCAPRKCDGPR84FFAR1FAAH

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-1123915-B1 Process for producing alpha, beta-unsaturated carboxylic acid esters and catalyst for use in such process NIPPON CATALYTIC CHEM IND (JP) 2004-07-28 EP disclosed
US-6541656-B2 Reacting an alpha, beta unsaturated carboxylic acid ester with a heterocyclic oxygen nitrogen, or sulfur compound NIPPON SHOKUBAI COMPANY, LTD. (JP) 2003-04-01 US disclosed
US-20010034300-A1 Reacting an alpha, beta unsaturated carboxylic acid ester with a heterocyclic oxygen nitrogen, or sulfur compound NIPPON SHOKUBAI COMPANY LTD. (JP) 2001-10-25 US disclosed
EP-1123915-A1 Process for producing alpha, beta-unsaturated carboxylic acid esters and catalyst for use in such process Nippon Shokubai Co., Ltd. (JP) 2001-08-16 EP disclosed