SCHEMBL141345

SCHEMBL141345

Cc1cc(C(C)(C)n2c(=O)n(C(C)(C)c3ccc(N=C=O)c(C)c3)c(=O)n(C(C)(C)c3ccc(N=C=O)c(C)c3)c2=O)ccc1N=C=O

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.40
TRPA1 O75762 1/20 0.40
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL4269741 0.80 CYP3A4 (0.47) CYP3A4TRPA1ALDH1A1HPGDTDP1
SCHEMBL6220134 0.75 CYP3A4 (0.46) CYP3A4TRPA1ALDH1A1HPGDTDP1
SCHEMBL6222140 0.72 CYP3A4 (0.44) CYP3A4TRPA1ALDH1A1HPGDTDP1
SCHEMBL27918615 0.72 CYP3A4 (0.50) CYP3A4TRPA1ALDH1A1HPGDTDP1
SCHEMBL9863183 0.70 CYP3A4 (0.44) CYP3A4TRPA1ALDH1A1HPGDTDP1
SCHEMBL29500358 0.70 CYP3A4 (0.58) CYP3A4TRPA1ALDH1A1HPGDTDP1
SCHEMBL48414 0.70 CYP3A4 (0.58) CYP3A4TRPA1ALDH1A1HPGDTDP1
SCHEMBL31115174 0.70 CYP3A4 (0.52) CYP3A4TRPA1ALDH1A1HPGDTDP1
SCHEMBL31115173 0.70 CYP3A4 (0.52) CYP3A4TRPA1ALDH1A1HPGDTDP1
SCHEMBL29351907 0.70 CYP3A4 (0.58) CYP3A4TRPA1ALDH1A1HPGDTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8431673-B2 Radiation curable compositions CYTEC SURFACE SPECIALTIES S.A. (BE) 2013-04-30 US disclosed
US-8431673-B2 Radiation curable compositions CYTEC SURFACE SPECIALTIES S.A. (BE) 2013-04-30 US disclosed
US-20120059186-A1 RADIATION CURABLE COMPOSITIONS ALLNEX BELGIUM S.A. (BE) 2012-03-08 US disclosed
US-20120059186-A1 RADIATION CURABLE COMPOSITIONS ALLNEX BELGIUM S.A. (BE) 2012-03-08 US disclosed
US-20110028641-A1 Radiation Curable Compositions CYTEC SURFACE SPECIALTIES, S.A. (BE) 2011-02-03 US disclosed
US-20110028641-A1 Radiation Curable Compositions CYTEC SURFACE SPECIALTIES, S.A. (BE) 2011-02-03 US disclosed
EP-2267050-A1 Radiation Curable Compositions Cytec Surface Specialties, S.A. (BE) 2010-12-29 EP disclosed
WO-2010145891-A1 RADIATION CURABLE COMPOSITIONS CYTEC SURFACE SPECIALTIES, S.A. (BE) 2010-12-23 WO disclosed
WO-2009065743-A1 RADIATION CURABLE COMPOSITIONS CYTEC SURFACE SPECIALTIES, S.A. (BE) 2009-05-28 WO 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-20120059186-A1 RADIATION CURABLE COMPOSITIONS XRCC6, XRCC5, RAD51 CYP3A4 2898/4885TRPA1 3852/4885ALDH1A1 27/4885

“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.