SCHEMBL1744734

SCHEMBL1744734

COC(=O)CCc1ccc(O)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GLA P06280 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.42
POLB P06746 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL15876199 0.89 MAPT (0.46) MAPTL3MBTL1
SCHEMBL11532393 0.85 MAPT (0.57) ALDH1A1GAAMAPTPOLB
SCHEMBL5990825 0.84 CYP4F2 (0.51) KDM4EALDH1A1GLAGAA
SCHEMBL29904573 0.83 TYR (0.57) POLB
SCHEMBL4711040 0.83 ALDH1A1 (0.51) KDM4EALDH1A1GLAGAAL3MBTL1
SCHEMBL4942431 0.83 TYR (0.57) POLB
SCHEMBL30581858 0.83 ALDH1A1 (0.51) KDM4EALDH1A1GLAGAAL3MBTL1
SCHEMBL16355739 0.83 NQO2 (0.39)
SCHEMBL1013029 0.83 EPHX2 (0.46) ALDH1A1GAAMAPTL3MBTL1
SCHEMBL433147 0.82 KDM4E (0.43) KDM4EALDH1A1GLAGAAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109562116-A Protona and protona derivative and promotor in cancer treatment 迪美公司 2019-04-02 CN claimed
CN-110167580-A Pharmaceutical composition and method for treating cancer 迪美公司 2019-08-23 CN disclosed
EP-1559422-B1 RECEPTOR FUNCTION CONTROLLING AGENT TAKEDA PHARMACEUTICAL (JP) 2014-04-30 EP disclosed
EP-2385032-A1 GPR40 Receptor function regulator Takeda Pharmaceutical Company Limited (JP) 2011-11-09 EP disclosed
US-7960369-B2 Receptor function regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-06-14 US disclosed
US-20090012093-A1 Receptor Function Regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-01-08 US disclosed
CN-1735408-A Receptor function controlling agent TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2006-02-15 CN disclosed
EP-1559422-A1 RECEPTOR FUNCTION CONTROLLING AGENT Takeda Pharmaceutical Company Limited (JP) 2005-08-03 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-20090012093-A1 Receptor Function Regulator GPR119, GIPR, INSR KDM4E 3200/4885ALDH1A1 4258/4885GLA 2978/4885

“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.