SCHEMBL2499786

SCHEMBL2499786

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

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.44
MAPT P10636 4/20 0.44
POLB P06746 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 5/20 0.42
TDP1 Q9NUW8 3/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 4/20 0.40
TSHR P16473 2/20 0.39
PKM P14618 2/20 0.37
PTPN1 P18031 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HSD17B10 Q99714 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SLC6A3 Q01959 1/20 0.37
ELANE P08246 1/20 0.37
F2 P00734 1/20 0.37
ADRB2 P07550 1/20 0.37
ADRB1 P08588 1/20 0.37
ADRB3 P13945 1/20 0.37

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
SCHEMBL2503630 0.92 MAPT (0.41) LMNAMAPTPOLBGAAKMT2A
SCHEMBL2508594 0.92 PPARG (0.42) LMNAMAPTPOLBGAAKMT2A
SCHEMBL2481989 0.92 PPARG (0.44) LMNAMAPTPOLBGAAKMT2A
SCHEMBL2508844 0.90 LMNA (0.39) LMNAMAPTPOLBGAAKMT2A
SCHEMBL2480597 0.89 MAPT (0.42) LMNAMAPTPOLBGAAKMT2A
SCHEMBL2476544 0.89 LMNA (0.42) LMNAMAPTPOLBGAAKMT2A
SCHEMBL2499657 0.89 MAPT (0.42) LMNAMAPTPOLBGAAKMT2A
SCHEMBL2499214 0.88 PPARG (0.45) LMNAMAPTPOLBGAAKMT2A
SCHEMBL2478999 0.87 MAPT (0.41) LMNAMAPTPOLBGAAKMT2A
SCHEMBL2509210 0.85 TDP1 (0.42) LMNAMAPTPOLBGAAKMT2A

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