SCHEMBL4640503

SCHEMBL4640503

CCc1cc(C(=O)OC(CC)CCC(C)C)c(C(=O)OC(CC)CCC(C)C)cc1Br

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 2/20 0.39
PRKCD Q05655 2/20 0.39
THRA P10827 2/20 0.35
THRB P10828 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
HPGD P15428 1/20 0.33
PTPN1 P18031 2/20 0.31
PTPN2 P17706 1/20 0.31
PTPN11 Q06124 1/20 0.31
ADRA1A P35348 1/20 0.31
SCN1A P35498 1/20 0.30
SCN2A Q99250 1/20 0.30
SCN3A Q9NY46 1/20 0.30

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
SCHEMBL4640506 0.95 PRKCA (0.36) PRKCAPRKCDTHRATHRBL3MBTL1
SCHEMBL4641007 0.90 PRKCA (0.43) PRKCAPRKCDL3MBTL1KMT2AADRA1A
SCHEMBL4627210 0.89 PRKCA (0.50) PRKCAPRKCDTHRATHRBL3MBTL1
SCHEMBL4639923 0.88 PRKCA (0.40) PRKCAPRKCDTHRATHRBL3MBTL1
SCHEMBL4640536 0.86 PRKCA (0.39) PRKCAPRKCDTHRATHRBL3MBTL1
SCHEMBL4639954 0.85 PRKCA (0.38) PRKCAPRKCDTHRATHRBL3MBTL1
SCHEMBL4640632 0.84 PRKCA (0.40) PRKCAPRKCDL3MBTL1ADRA1ASCN1A
SCHEMBL4641009 0.84 PRKCA (0.40) PRKCAPRKCDTHRATHRBMAPT
SCHEMBL4639926 0.84 ALDH1A1 (0.39) PRKCAPRKCDTHRATHRB
SCHEMBL4640041 0.84 ALDH1A1 (0.39) PRKCAPRKCDTHRATHRB

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
EP-1188739-B1 PHTHALIC DIESTER DERIVATIVES AND ELECTRON DONORS TOHO TITANIUM CO LTD (JP) 2008-08-13 EP disclosed
US-6670497-B2 Dialkyl (at least one of which is a C4-8 tertiary alkyl) ester of an alkyl- or halo-substituted phthalic acid; used in an olefin polymerization catalyst TOHO TITANIUM CO., LTD. (JP) 2003-12-30 US disclosed
US-20030036594-A1 Phthalic diester derivatives and electron donors TOHO TITANIUM CO., LTD. (JP) 2003-02-20 US disclosed
EP-1188739-A1 PHTHALIC DIESTER DERIVATIVES AND ELECTRON DONORS TOHO TITANIUM CO., LTD. (JP) 2002-03-20 EP 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-20030036594-A1 Phthalic diester derivatives and electron donors HPD, ETFA, PPOX PRKCA 1200/4885PRKCD 552/4885THRA 4644/4885

“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.