SCHEMBL1788486

SCHEMBL1788486

C=C(CCC=Cc1cc(O)c(O)c(OC)c1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.48
PTGS2 P35354 2/20 0.48
PKM P14618 1/20 0.48
ALOX5 P09917 7/20 0.46
CYP1A2 P05177 2/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2B6 P20813 1/20 0.46
STAT3 P40763 2/20 0.45
NFE2L2 Q16236 2/20 0.45
PTGES O14684 1/20 0.45
NFKB1 P19838 2/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
TUBB1 Q9H4B7 1/20 0.43
KDM4E B2RXH2 2/20 0.43
GAA P10253 1/20 0.43
PIM1 P11309 1/20 0.42
EGFR P00533 2/20 0.41

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
SCHEMBL1791116 0.95 PTGS1 (0.54) PTGS1PTGS2PKMALOX5CYP1A2
SCHEMBL1791984 0.87 CYP3A4 (0.36) PTGS2ALOX5CYP3A4CYP2C9NFKB1
SCHEMBL1789695 0.86 ALDH1A1 (0.54) CYP1A2TUBB1KDM4EGAAALDH1A1
SCHEMBL1788715 0.86 KDM4E (0.57) PTGS1PTGS2PKMALOX5CYP1A2
SCHEMBL1788677 0.83 KDM4E (0.55) PTGS1PTGS2CYP1A2NFE2L2KDM4E
SCHEMBL2492516 0.78 PTGS1 (0.54) PTGS1PTGS2PKMALOX5CYP1A2
SCHEMBL30901848 0.77 CYP3A4 (0.61) PTGS1PTGS2PKMALOX5CYP1A2
SCHEMBL152269 0.77 TUBB1 (0.56) PTGS1PTGS2PKMALOX5CYP1A2
SCHEMBL4632508 0.77 TUBB1 (0.56) PTGS1PTGS2PKMALOX5CYP1A2
SCHEMBL5965920 0.76 ALDH1A1 (0.56) PTGS1ALOX5CYP3A4CYP2C9NFKB1

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 PTGS1 1273/4885PTGS2 976/4885PKM 452/4885

“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.