SCHEMBL2076853

SCHEMBL2076853

C=CCN1C(=O)C2CC=C(C)CC2C1=O

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.47
TSHR P16473 3/20 0.44
GAA P10253 2/20 0.44
TDP1 Q9NUW8 3/20 0.43
RXFP1 Q9HBX9 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
USP2 O75604 1/20 0.42
POLB P06746 2/20 0.41
APEX1 P27695 1/20 0.41
HPGD P15428 2/20 0.41
ESR1 P03372 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPT P10636 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL2076742 0.82 ALDH1A1 (0.39) ALDH1A1TDP1MEN1KMT2APOLB
SCHEMBL2077887 0.82 ALDH1A1 (0.39) ALDH1A1TDP1MEN1KMT2APOLB
SCHEMBL2077574 0.81 ALDH1A1 (0.39) ALDH1A1TSHRTDP1MEN1KMT2A
SCHEMBL2077789 0.81 ALDH1A1 (0.39) ALDH1A1TDP1MEN1KMT2APOLB
SCHEMBL2075930 0.81 ALDH1A1 (0.39) ALDH1A1TSHRGAATDP1MEN1
SCHEMBL2076280 0.79 ALDH1A1 (0.40) ALDH1A1TDP1MEN1KMT2APOLB
SCHEMBL2077414 0.79 ALDH1A1 (0.39) ALDH1A1TDP1MEN1KMT2APOLB
SCHEMBL2076332 0.79 ALDH1A1 (0.37) ALDH1A1TSHRTDP1RXFP1MEN1
SCHEMBL3956791 0.78 ALDH1A1 (0.49) ALDH1A1TSHRTDP1KMT2AUSP2
SCHEMBL729399 0.78 ALDH1A1 (0.49) ALDH1A1TSHRTDP1KMT2AUSP2

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 ALDH1A1 607/4885TSHR 2097/4885GAA 3358/4885

“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.