SCHEMBL2433833

SCHEMBL2433833

O=C(O)c1ccc2c(ccc3c4c(ccc32)C(=O)OC4=O)c1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYMS P04818 1/20 0.50
CA12 O43570 5/20 0.36
CA7 P43166 5/20 0.36
CA1 P00915 4/20 0.36
CA4 P22748 2/20 0.36
MAPT P10636 5/20 0.36
ALDH1A1 P00352 5/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
MAPK1 P28482 2/20 0.36
POLB P06746 2/20 0.36
RECQL P46063 2/20 0.36
LMNA P02545 2/20 0.36
THRB P10828 1/20 0.36
WDR5 P61964 1/20 0.34
GPR35 Q9HC97 1/20 0.34
CA2 P00918 2/20 0.34
FTO Q9C0B1 1/20 0.34
CA9 Q16790 1/20 0.34
KDM4E B2RXH2 2/20 0.33

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
SCHEMBL759879 0.98 TYMS (0.51) TYMSCA12CA7CA1CA4
SCHEMBL2434561 0.85 TYMS (0.53) TYMSCA12CA7CA1CA4
SCHEMBL475904 0.81 TYMS (0.61) TYMSCA12CA7CA1CA4
SCHEMBL202564 0.77 CYP1A2 (0.50) CA12CA7CA1CA4MAPT
SCHEMBL11350894 0.76 TYMS (0.47) TYMSCA12CA7CA1CA4
SCHEMBL18338732 0.76 ALDH1A1 (0.50) TYMSCA12CA7CA1CA4
SCHEMBL48997 0.75 CYP1A2 (0.52) CA12CA7CA1CA4MAPT
SCHEMBL29420737 0.75 CYP1A2 (0.52) CA12CA7CA1CA4MAPT
SCHEMBL25187023 0.73 TYMS (0.51) TYMSCA12CA7CA1CA4
SCHEMBL6541546 0.73 TYMS (0.51) TYMSCA12CA7CA1CA4

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10577725-B2 Fiber and fiber structure TEIJIN LIMITED (JP) 2020-03-03 US disclosed
EP-2374833-B1 METHOD FOR USING CYCLIC CARBODIIMIDE TEIJIN LTD (JP) 2017-12-06 EP disclosed
US-9758496-B2 Method of using a cyclic carbodiimide TEIJIN LIMITED (JP) 2017-09-12 US disclosed
EP-2380883-B1 CYCLIC CARBODIIMIDE COMPOUNDS TEIJIN LTD (JP) 2015-12-02 EP disclosed
US-8987440-B2 Cyclic carbodiimide compounds TEIJIN LIMITED (JP) 2015-03-24 US disclosed
EP-2479320-B1 FIBER AND FIBER STRUCTURE TEIJIN LTD (JP) 2015-02-25 EP disclosed
CN-102245585-B Cyclic carbodiimide compound TEIJIN LTD 2014-12-17 CN disclosed
CN-102320977-B Cyclic carbodiimide compounds TEIJIN LTD 2014-11-12 CN disclosed
EP-2581368-A1 CYCLIC CARBODIIMIDE COMPOUND Teijin Limited (JP) 2013-04-17 EP disclosed
US-20130079510-A1 CYCLIC CARBODIIMIDE COMPOUND TEIJIN LIMITED (JP) 2013-03-28 US disclosed
EP-2479320-A1 FIBER AND FIBER STRUCTURE Teijin Limited (JP) 2012-07-25 EP disclosed
US-20120184166-A1 FIBER AND FIBER STRUCTURE TEIJIN LIMITED (JP) 2012-07-19 US disclosed
CN-102597344-A Fiber and fiber structure TEIJIN LTD 2012-07-18 CN disclosed
CN-102320977-A The ring-type carbodiimide compound TEIJIN LTD 2012-01-18 CN disclosed
CN-102320976-A The ring-type carbodiimide compound TEIJIN LTD 2012-01-18 CN disclosed
CN-102245585-A Cyclic carbodiimide compound TEIJIN LTD 2011-11-16 CN disclosed
EP-2380883-A1 CYCLIC CARBODIIMIDE COMPOUNDS Teijin Limited (JP) 2011-10-26 EP disclosed
US-20110251384-A1 CYCLIC CARBODIIMIDE COMPOUNDS TEIJIN LIMITED (JP) 2011-10-13 US disclosed
EP-2374833-A1 METHOD FOR USING CYCLIC CARBODIMIDE Teijin Limited (JP) 2011-10-12 EP disclosed
US-20110237755-A1 METHOD OF USING A CYCLIC CARBODIIMIDE TEIJIN LIMITED (JP) 2011-09-29 US 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 (2 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-20110251384-A1 CYCLIC CARBODIIMIDE COMPOUNDS APEX1, LIG4, EPB41 TYMS 1991/4885CA12 3252/4885CA7 1651/4885
US-20130079510-A1 CYCLIC CARBODIIMIDE COMPOUND CNOT9, CNOT1, ARPC4 TYMS 2365/4885CA12 1709/4885CA7 1705/4885

“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.