SCHEMBL2075419

SCHEMBL2075419

C=CCN1C(=O)C2=C(C1=O)C1CCC2C1CCCCCC

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.34
ALDH1A1 P00352 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
CASP3 P42574 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HTT P42858 1/20 0.31
MAPT P10636 1/20 0.31
USP2 O75604 1/20 0.30
HSD17B10 Q99714 1/20 0.30
MIF P14174 1/20 0.30
TSHR P16473 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
SCHEMBL2075398 0.99 CYP1A2 (0.32) CYP1A2L3MBTL1CASP3MAPT
SCHEMBL2076072 0.94 CASP3 (0.33) ALDH1A1L3MBTL1CASP3MAPT
SCHEMBL2077880 0.88 CASP3 (0.34) ALDH1A1L3MBTL1CASP3MAPT
SCHEMBL2075078 0.82 CASP3 (0.36) ALDH1A1L3MBTL1CASP3MAPT
SCHEMBL2075841 0.79 ALOX5 (0.32)
SCHEMBL2078236 0.77 ALOX5 (0.30)
SCHEMBL2076501 0.76 MAPT (0.40) ALDH1A1L3MBTL1CASP3KDM4EHTT
SCHEMBL2075051 0.75 MEN1 (0.43) ALDH1A1L3MBTL1CASP3MAPT
SCHEMBL2077443 0.73 CASP3 (0.30) CASP3
SCHEMBL2076902 0.72 CASP3 (0.33) ALDH1A1L3MBTL1CASP3MAPT

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-2028183-B1 NOVEL EPOXY COMPOUND AND METHOD FOR PRODUCING THE SAME SHOWA DENKO KK (JP) 2014-03-26 EP disclosed
US-7863461-B2 Epoxy compounds and method for production of the same SHOWA DENKO K.K. (JP) 2011-01-04 US disclosed
US-20090253915-A1 NOVEL EPOXY COMPOUNDS AND METHOD FOR PRODUCTION OF THE SAME SHOWA DENKO K.K. (JP) 2009-10-08 US disclosed
EP-2028183-A1 NOVEL EPOXY COMPOUND AND METHOD FOR PRODUCING THE SAME Showa Denko K.K. (JP) 2009-02-25 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-20090253915-A1 NOVEL EPOXY COMPOUNDS AND METHOD FOR PRODUCTION OF THE SAME PTGIS, PTGES, CYP2E1 CYP1A2 79/4885ALDH1A1 607/4885L3MBTL1 3187/4885

“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.