SCHEMBL577696

SCHEMBL577696

OCCOc1ccc(C2c3ccccc3-c3ccccc32)cc1C1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 1/20 0.44
PTGDR2 Q9Y5Y4 14/20 0.44
PTGDR Q13258 6/20 0.40
HTR1D P28221 2/20 0.40
HTR1B P28222 2/20 0.40
PTGER2 P43116 1/20 0.40
PTGS2 P35354 1/20 0.37
C5AR1 P21730 1/20 0.36
ALOX5AP P20292 1/20 0.35
FEN1 P39748 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
SCHEMBL22229831 0.84 PTGDR2 (0.51) SLC6A9PTGDR2PTGDRHTR1DHTR1B
SCHEMBL11373736 0.80 PTGDR2 (0.63) SLC6A9PTGDR2PTGDRHTR1DHTR1B
SCHEMBL516573 0.80 PTGDR2 (0.63) SLC6A9PTGDR2PTGDRHTR1DHTR1B
SCHEMBL577449 0.79 TP53 (0.49) SLC6A9PTGDR2ALOX5APFEN1
SCHEMBL7637813 0.78 PTGDR2 (0.60) SLC6A9PTGDR2PTGDRHTR1DHTR1B
SCHEMBL577512 0.78 L3MBTL1 (0.39) ALOX5APFEN1
SCHEMBL382823 0.76 SLC6A9 (0.43) SLC6A9PTGDR2PTGDRHTR1DHTR1B
SCHEMBL29445698 0.76 SLC6A9 (0.43) SLC6A9PTGDR2PTGDRHTR1DHTR1B
SCHEMBL576514 0.76 KDM4E (0.39) ALOX5APFEN1
SCHEMBL8684002 0.76 C5AR1 (0.47) SLC6A9PTGDR2C5AR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2272889-B1 POLYCARBONATE RESIN HAVING ULTRAVIOLET ABSORBING CAPABILITY, RESIN COMPOSITION AND OPTICAL MATERIAL MITSUBISHI GAS CHEMICAL CO (JP) 2013-09-04 EP disclosed
EP-2418253-A1 POLYCARBONATE RESIN COMPOSITION, PROCESS FOR PRODUCING MOLDED ARTICLE THEREFROM, AND OPTICAL LENS Mitsubishi Gas Chemical Company, Inc. (JP) 2012-02-15 EP disclosed
EP-2180014-B1 Method for producing thermoplastic resin, polyester resin and polycarbonate resin, and their applications MITSUBISHI GAS CHEMICAL CO (JP) 2011-12-14 EP disclosed
EP-2272889-A1 POLYCARBONATE RESIN HAVING ULTRAVIOLET ABSORBING CAPABILITY, RESIN COMPOSITION AND OPTICAL MATERIAL Mitsubishi Gas Chemical Company, Inc. (JP) 2011-01-12 EP disclosed
EP-2180014-A1 Method for producing thermoplastic resin, polyester resin and polycarbonate resin, and their applications MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2010-04-28 EP disclosed