SCHEMBL2477415

SCHEMBL2477415

CCc1cc(C2CCCC2)c(C)c(OC(=O)c2ccccc2)c1OC(=O)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.39
MAPT P10636 2/20 0.39
GAA P10253 2/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 5/20 0.39
ALDH1A1 P00352 2/20 0.39
PTGDR2 Q9Y5Y4 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2D6 P10635 1/20 0.38
SCN1A P35498 1/20 0.38
SCN2A Q99250 1/20 0.38
SCN3A Q9NY46 1/20 0.38
MEN1 O00255 1/20 0.37
ATM Q13315 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
STAT3 P40763 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
CHRNB2 P17787 1/20 0.36
CHRNA5 P30532 1/20 0.36

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
SCHEMBL2886892 0.99 PTGDR2 (0.40) LMNAMAPTGAAPOLBKMT2A
SCHEMBL2506623 0.92 PPARG (0.38) LMNAMAPTGAAPOLBKMT2A
SCHEMBL2499852 0.91 PPARG (0.38) LMNAMAPTGAAPOLBKMT2A
SCHEMBL2508648 0.88 LMNA (0.39) LMNAMAPTGAAPOLBKMT2A
SCHEMBL2504969 0.88 LMNA (0.39) LMNAMAPTGAAPOLBKMT2A
SCHEMBL2502609 0.87 PTGDR2 (0.40) LMNAMAPTGAAPOLBKMT2A
SCHEMBL2510238 0.87 PTGDR2 (0.40) LMNAMAPTGAAPOLBKMT2A
SCHEMBL2505747 0.87 PTGDR2 (0.40) LMNAMAPTGAAPOLBKMT2A
SCHEMBL2499540 0.87 PTGDR2 (0.40) LMNAMAPTGAAPOLBKMT2A
SCHEMBL2508226 0.86 KMT2A (0.39) LMNAMAPTGAAPOLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2376423-A1 PRODUCTION OF SUBSTITUTED PHENYLENE AROMATIC DIESTERS Dow Global Technologies LLC (US) 2011-10-19 EP disclosed
WO-2010078519-A1 PRODUCTION OF SUBSTITUTED PHENYLENE AROMATIC DIESTERS DOW GLOBAL TECHNOLOGIES INC. (US) 2010-07-08 WO disclosed