SCHEMBL4641198

SCHEMBL4641198

CCc1cc(C(=O)O)c(C(=O)OC(CC)C(C)(C)C)cc1Cl

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CLCN2 P51788 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.32
ALDH1A1 P00352 3/20 0.31
TP53 P04637 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA3 P07451 1/20 0.31
CA4 P22748 1/20 0.31
CA6 P23280 1/20 0.31
CA5A P35218 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
CA13 Q8N1Q1 1/20 0.31
CISD1 Q9NZ45 1/20 0.31
CA14 Q9ULX7 1/20 0.31
CA5B Q9Y2D0 1/20 0.31

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
SCHEMBL4640675 1.00 ATM (0.33) ATMMEN1KMT2ACLCN2MRGPRX4
SCHEMBL4640671 0.95 GRIN2D (0.32) MEN1KMT2A
SCHEMBL4640058 0.92 MEN1 (0.38) ATMMEN1KMT2AALDH1A1CISD1
SCHEMBL4642995 0.90 MEN1 (0.35) MEN1KMT2ACLCN2ALDH1A1KDM4E
SCHEMBL4640703 0.88 ALDH1A1 (0.38) MEN1KMT2AALDH1A1CISD1TAAR1
SCHEMBL4640736 0.87 UTS2R (0.34) ATMMEN1KMT2AALDH1A1CA12
SCHEMBL4640895 0.87 UTS2R (0.34) ATMMEN1KMT2AALDH1A1CA12
SCHEMBL4643639 0.86 HSD17B10 (0.35) ATMMEN1KMT2ACA12CA1
SCHEMBL4640036 0.85 MEN1 (0.32) MEN1KMT2AALDH1A1GABRPGABRD
SCHEMBL4639978 0.85 MEN1 (0.32) MEN1KMT2AALDH1A1GABRPGABRD

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 ATM 4248/4885MEN1 3562/4885KMT2A 3313/4885

“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.