SCHEMBL14770638

SCHEMBL14770638

COc1ccc(C(C)c2nc3cc(OC(F)(F)F)ccc3[nH]2)cc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 1/20 0.52
RUNX1 Q01196 3/20 0.42
PDE2A O00408 8/20 0.39
TRPV1 Q8NER1 2/20 0.38
PTGES O14684 1/20 0.37
ALOX5 P09917 1/20 0.37
LTC4S Q16873 1/20 0.37
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CBFB Q13951 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
SCHEMBL14770549 0.88 ALDH1A1 (0.42) PTGESALOX5LTC4SKDM4ELMNA
SCHEMBL14770707 0.87 SCN10A (0.48) SCN10ARUNX1PDE2ATRPV1
SCHEMBL14770646 0.86 SCN10A (0.40) SCN10APDE2APTGESALOX5LTC4S
SCHEMBL14770640 0.85 SCN10A (0.44) SCN10APDE2APTGESALOX5LTC4S
SCHEMBL12065643 0.84 SCN10A (0.46) SCN10ARUNX1PDE2ATRPV1
SCHEMBL14770492 0.84 AMY1A (0.41) SCN10APTGESALOX5LTC4SKDM4E
SCHEMBL23676457 0.83 SCN10A (0.56) SCN10ARUNX1TRPV1KDM4ELMNA
SCHEMBL23280101 0.82 IDH1 (0.49) SCN10APDE2ATRPV1KDM4ELMNA
SCHEMBL12065285 0.82 SCN10A (0.46) SCN10ARUNX1PDE2ATRPV1
SCHEMBL14770535 0.81 MEN1 (0.53) PTGESALOX5LTC4SKDM4ELMNA

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-9096531-B2 Fused imidazole derivative TOA EIYO LTD. (JP) 2015-08-04 US disclosed
US-20130065896-A1 FUSED IMIDAZOLE DERIVATIVE TOA EIYO LTD. (JP) 2013-03-14 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-20130065896-A1 FUSED IMIDAZOLE DERIVATIVE CACNA1E, CACNA1G, CACNA1A SCN10A 85/4885RUNX1 660/4885PDE2A 1306/4885

“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.