SCHEMBL15933562

SCHEMBL15933562

CCC1(CC(C)=O)COC1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.36
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TSHR P16473 1/20 0.33
POLB P06746 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL16520582 0.82 CYP1A2 (0.38) EPHX1ALDH1A1TSHR
SCHEMBL9895608 0.79 EPHX1 (0.31) EPHX1TSHR
SCHEMBL13242767 0.78
SCHEMBL13679324 0.77 EPHX1 (0.36) EPHX1
SCHEMBL1352530 0.77
SCHEMBL18626278 0.77 EPHX1 (0.32) EPHX1
SCHEMBL11420167 0.77 ALDH1A1 (0.40) EPHX1ALDH1A1TSHRPOLBHSD17B10
SCHEMBL12027549 0.77 GAA (0.39) ALDH1A1TSHRPOLBHSD17B10
SCHEMBL782180 0.75 EPHX1 (0.31) EPHX1TSHR
SCHEMBL15931191 0.74 EPHX1 (0.30) EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9518053-B2 Fluorinated integrin antagonists SCIFLUOR LIFE SCIENCES, INC. (US) 2016-12-13 US disclosed
US-20160130270-A1 FLUORINATED 3-(2-OXO-3-(3-ARYLPROPYL)IMIDAZOLIDIN-1-YL)-3-ARYLPROPANOIC ACID DERIVATIVES FELIQS CORPORATION (JP) 2016-05-12 US disclosed
US-9266884-B2 Fluorinated 3-(2-oxo-3-(3-arylpropyl)imidazolidin-1-y1)-3-arylpropanoic acid derivatives SCIFLUOR LIFE SCIENCES, INC. (US) 2016-02-23 US disclosed
US-20150057308-A1 Fluorinated 3-(2-Oxo-3-(3-Arylpropyl)Imidazolidin-1-yl)-3-Arylpropanoic Acid Derivatives FELIQS CORPORATION (JP) 2015-02-26 US disclosed
US-8901144-B2 Fluorinated 3-(2-oxo-3-(3-arylpropyl)imidazolidin-1-yl)-3-arylpropanoic acid derivatives SCIFLUOR LIFE SCIENCES, LLC (US) 2014-12-02 US disclosed
US-20140221410-A1 Fluorinated 3-(2-Oxo-3-(3-Arylpropyl)Imidazolidin-1-yl)-3-Arylpropanoic Acid Derivatives SCIFLUOR LIFE SCIENCES, LLC (US) 2014-08-07 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 (3 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-20150057308-A1 Fluorinated 3-(2-Oxo-3-(3-Arylpropyl)Imidazolidin-1-yl)-3-Arylpropanoic Acid Derivatives ITGB3, ITGA2, ITGA1 EPHX1 1967/4885ALDH1A1 765/4885TDP1 4358/4885
US-20160130270-A1 FLUORINATED 3-(2-OXO-3-(3-ARYLPROPYL)IMIDAZOLIDIN-1-YL)-3-ARYLPROPANOIC ACID DERIVATIVES ITGB3, ITGA2, ITGA1 EPHX1 1967/4885ALDH1A1 765/4885TDP1 4358/4885
US-20140221410-A1 Fluorinated 3-(2-Oxo-3-(3-Arylpropyl)Imidazolidin-1-yl)-3-Arylpropanoic Acid Derivatives ITGB3, ITGA2, ITGA1 EPHX1 1967/4885ALDH1A1 765/4885TDP1 4358/4885

“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.