SCHEMBL674836

SCHEMBL674836

CCCCCCCCc1cc(C(C)(C)C)c(OC(c2c(C(C)(C)C)cc(CCCCCCCC)cc2C(C)(C)C)C(CO)(CO)CO)c(C(C)(C)C)c1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 4/20 0.38
CNR1 P21554 4/20 0.36
CNR2 P34972 3/20 0.36
CYP3A4 P08684 1/20 0.36
TNNC1 P63316 5/20 0.35
S1PR1 P21453 3/20 0.35
S1PR4 O95977 2/20 0.35
S1PR3 Q99500 2/20 0.35
S1PR5 Q9H228 2/20 0.35
SGPL1 O95470 1/20 0.35
GPR183 P32249 1/20 0.35
CERS2 Q96G23 1/20 0.35
SPHK2 Q9NRA0 3/20 0.35
S1PR2 O95136 1/20 0.35
FUT7 Q11130 1/20 0.34
SPHK1 Q9NYA1 1/20 0.34

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
SCHEMBL6058590 1.00 PTGS2 (0.38) PTGS2CNR1CNR2CYP3A4TNNC1
SCHEMBL6059057 1.00 PTGS2 (0.38) PTGS2CNR1CNR2CYP3A4TNNC1
SCHEMBL10607967 0.85 CNR2 (0.40) CNR1CNR2
SCHEMBL6747519 0.85 CNR2 (0.40) CNR1CNR2
SCHEMBL499915 0.84 HSPA5 (0.40) CYP3A4
SCHEMBL10456461 0.83 CNR2 (0.40) CNR1CNR2
SCHEMBL4659187 0.82 CNR2 (0.38) CNR1CNR2
SCHEMBL674845 0.81 CNR2 (0.38) CNR1CNR2
SCHEMBL29139883 0.81 HSPA5 (0.37) CYP3A4
SCHEMBL11025710 0.81 HSPA5 (0.37) CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8062557-B2 Thermoplastic resin composition for producing automobile exterior parts DSM IP ASSETS B.V. (NL) 2011-11-22 US disclosed
US-20090309073-A1 THERMOPLASTIC RESIN COMPOSITION FOR PRODUCING AUTOMOBILE EXTERIOR PARTS DSM IP ASSETS B.V. (NL) 2009-12-17 US disclosed
EP-2028230-A1 THERMOPLASTIC RESIN COMPOSITION FOR PRODUCING AUTOMOBILE EXTERIOR PART Mitsubishi Engineering-Plastics Corporation (JP) 2009-02-25 EP disclosed
US-7056963-B2 Polyester resin composition and process for the preparation thereof KANEKA CORPORATION (JP) 2006-06-06 US disclosed
EP-1283245-B1 POLYESTER RESIN COMPOSITION AND PROCESS FOR THE PREPARATION THEREOF KANEKA CORP (JP) 2005-11-09 EP disclosed
US-20040024139-A1 Polyester resin composition and process for the preparation thereof KANEKA CORPORATION (JP) 2004-02-05 US disclosed
EP-1283245-A1 POLYESTER RESIN COMPOSITION AND PROCESS FOR THE PREPARATION THEREOF KANEKA CORPORATION (JP) 2003-02-12 EP disclosed