SCHEMBL2505683

SCHEMBL2505683

CCCc1cc(C(C)(C)C)c(CC(C)C)c(OC(=O)c2ccccc2)c1OC(=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.41
PPARA Q07869 9/20 0.41
MAPT P10636 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 2/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
ELANE P08246 2/20 0.36
PKM P14618 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 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
SCHEMBL2501724 0.92 TDP1 (0.40) MAPTTDP1L3MBTL1LMNAPOLB
SCHEMBL2503869 0.90 PPARG (0.42) PPARGPPARAMAPTTDP1L3MBTL1
SCHEMBL2504704 0.89 PPARG (0.41) PPARGPPARAMAPTTDP1L3MBTL1
SCHEMBL2502295 0.87 PPARG (0.44) PPARGPPARAMAPTLMNAPOLB
SCHEMBL2888361 0.86 PPARG (0.40) PPARGPPARAMAPTTDP1L3MBTL1
SCHEMBL2506611 0.86 PPARG (0.43) PPARGPPARAMAPTLMNAPOLB
SCHEMBL2482108 0.86 PPARG (0.43) PPARGPPARAMAPTLMNAPOLB
SCHEMBL2503053 0.85 PPARG (0.43) PPARGPPARAMAPTLMNAPOLB
SCHEMBL2484659 0.85 TDP1 (0.42) PPARGPPARAMAPTTDP1L3MBTL1
SCHEMBL2502933 0.84 PPARG (0.41) PPARGPPARAMAPTTDP1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8604235-B2 Production of substituted phenylene aromatic diesters and compositions DOW GLOBAL TECHNOLOGIES LLC (US) 2013-12-10 US disclosed
EP-2376423-A1 PRODUCTION OF SUBSTITUTED PHENYLENE AROMATIC DIESTERS Dow Global Technologies LLC (US) 2011-10-19 EP disclosed
US-20100204506-A1 Production of Substituted Phenylene Aromatic Diesters and Compositions W. R. GRACE & CO.-CONN. 2010-08-12 US disclosed
WO-2010078519-A1 PRODUCTION OF SUBSTITUTED PHENYLENE AROMATIC DIESTERS DOW GLOBAL TECHNOLOGIES INC. (US) 2010-07-08 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100204506-A1 Production of Substituted Phenylene Aromatic Diesters and Compositions PAH, DDC, DDT PPARG 877/4885PPARA 398/4885MAPT 2384/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.