SCHEMBL2314647

SCHEMBL2314647

C=C(CCCNC(=O)Oc1cccc(-c2ccccc2)c1)C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.54
EPHX1 P07099 1/20 0.53
PTGS2 P35354 1/20 0.53

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
SCHEMBL2315680 0.92 EPHX1 (0.55) EPHX1
SCHEMBL2316622 0.88 FAAH (0.51) FAAH
SCHEMBL2318794 0.88 TAAR1 (0.47)
SCHEMBL2314583 0.85 KMT2A (0.51)
SCHEMBL2315066 0.85 FAAH (0.43) FAAH
SCHEMBL2314702 0.82 GAA (0.43)
SCHEMBL25488385 0.82 PTGS2 (0.66) FAAHPTGS2
SCHEMBL2314945 0.80 FAAH (0.51) FAAH
SCHEMBL2316314 0.80 TAAR1 (0.49) FAAH
SCHEMBL820563 0.79 FFAR4 (0.59)

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
EP-2354845-B1 Photopolymer Composition for the Manufacturing of Holographic Media COVESTRO DEUTSCHLAND AG (DE) 2015-12-23 EP claimed
EP-2354845-B1 Photopolymer Composition for the Manufacturing of Holographic Media COVESTRO DEUTSCHLAND AG (DE) 2015-12-23 EP disclosed
EP-2354845-A1 (Meth)acrylate writing monomers Bayer MaterialScience AG (DE) 2011-08-10 EP disclosed