SCHEMBL6325406

SCHEMBL6325406

CCCCCCC1CCC(CCCC)C1=O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.47
EPHX1 P07099 1/20 0.42
ALDH1A1 P00352 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
PPARG P37231 1/20 0.38
HLCS P50747 1/20 0.38
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CYP19A1 P11511 4/20 0.36
ALOX5 P09917 1/20 0.36
S1PR2 O95136 1/20 0.36
S1PR4 O95977 1/20 0.36
S1PR1 P21453 1/20 0.36
S1PR3 Q99500 1/20 0.36
S1PR5 Q9H228 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
SCHEMBL6326280 1.00 CYP1A2 (0.47) CYP1A2EPHX1ALDH1A1L3MBTL1PPARG
SCHEMBL6325530 0.98 CYP1A2 (0.48) CYP1A2EPHX1ALDH1A1L3MBTL1PPARG
SCHEMBL6332026 0.98 CYP1A2 (0.48) CYP1A2EPHX1ALDH1A1L3MBTL1PPARG
SCHEMBL6324122 0.98 CYP1A2 (0.48) CYP1A2EPHX1ALDH1A1L3MBTL1PPARG
SCHEMBL6327995 0.98 CYP1A2 (0.44) CYP1A2EPHX1ALDH1A1L3MBTL1PPARG
SCHEMBL6332614 0.96 CYP1A2 (0.46) CYP1A2EPHX1ALDH1A1L3MBTL1PPARG
SCHEMBL6327304 0.93 CYP1A2 (0.41) CYP1A2ALDH1A1HTTCYP19A1
SCHEMBL23041063 0.89 CYP1A2 (0.42) CYP1A2EPHX1ALDH1A1L3MBTL1PPARG
SCHEMBL28858292 0.89 CYP1A2 (0.46) CYP1A2EPHX1ALDH1A1L3MBTL1PPARG
SCHEMBL3267370 0.87 CYP1A2 (0.43) CYP1A2EPHX1ALDH1A1L3MBTL1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050009928-A1 Cyclopentanone derivative ZEON CORPORATION (JP) 2005-01-13 US disclosed
EP-1420005-A1 CYCLOPENTANONE DERIVATIVE Zeon Corporation (JP) 2004-05-19 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-20050009928-A1 Cyclopentanone derivative PTGIS, CYP51A1, TRPA1 CYP1A2 57/4885EPHX1 1386/4885ALDH1A1 954/4885

“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.