SCHEMBL1805358

SCHEMBL1805358

CC=CC(C=C(C)C(=O)O)C(C)C(=O)OCC

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HCAR2 Q8TDS4 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
SCHEMBL8937961 0.74 GLO1 (0.39) CYP2D6CYP2C9CYP2C19ALDH1A1LMNA
SCHEMBL8937965 0.74 GLO1 (0.39) CYP2D6CYP2C9CYP2C19ALDH1A1LMNA
SCHEMBL4632127 0.71 ALDH1A1 (0.36) CYP2D6CYP2C9CYP2C19ALDH1A1LMNA
SCHEMBL4632124 0.71 ALDH1A1 (0.36) CYP2D6CYP2C9CYP2C19ALDH1A1LMNA
SCHEMBL11369612 0.70 ALDH1A1 (0.35) CYP2D6CYP2C9CYP2C19ALDH1A1LMNA
SCHEMBL21493254 0.69 PTGS1 (0.31)
SCHEMBL1929624 0.68 ALDH1A1 (0.40) CYP2D6CYP2C9CYP2C19ALDH1A1LMNA
SCHEMBL10709760 0.68 ALDH1A1 (0.40) CYP2D6CYP2C9CYP2C19ALDH1A1LMNA
SCHEMBL1929622 0.68 ALDH1A1 (0.40) CYP2D6CYP2C9CYP2C19ALDH1A1LMNA
SCHEMBL1806183 0.67 ALDH1A1 (0.40) CYP2D6CYP2C9CYP2C19ALDH1A1LMNA

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-20110123929-A1 OXIME COMPOUND, PHOTOSENSITIVE COMPOSITION, COLOR FILTER, PRODUCTION METHOD FOR THE COLOR FILTER, AND LIQUID CRYSTAL DISPLAY ELEMENT FUJIFILM CORPORATION (JP) 2011-05-26 US disclosed
US-7041416-B2 Photosensitive resin composition, transfer material, image forming method, color filter and producing method thereof and photomask and producing method thereof FUJI PHOTO FILM CO., LTD. (JP) 2006-05-09 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 (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-20110123929-A1 OXIME COMPOUND, PHOTOSENSITIVE COMPOSITION, COLOR FILTER, PRODUCTION METHOD FOR THE COLOR FILTER, AND LIQUID CRYSTAL DISPLAY ELEMENT PPOX, CRY2, HCCS CYP2D6 220/4885CYP2C9 39/4885CYP2C19 106/4885

“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.