SCHEMBL12065619

SCHEMBL12065619

CCOC(c1ccc(C(F)(F)F)cc1)c1nc2cc(F)ccc2[nH]1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 2/20 0.38
▸ SCN10A Q9Y5Y9 2/20 0.37
▸ MLKL Q8NB16 2/20 0.37
▸ ALPL P05186 1/20 0.36
▸ ALPI P09923 1/20 0.36
▸ ALPG P10696 1/20 0.36
▸ PDE2A O00408 5/20 0.35
▸ BRD4 O60885 2/20 0.32
▸ CASR P41180 1/20 0.32
▸ AAK1 Q2M2I8 1/20 0.32

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
SCHEMBL12065655 0.87 MLKL (0.50) IDO1SCN10AMLKLALPLALPI
SCHEMBL12066566 0.87 PRCP (0.42) IDO1MLKLALPLALPIALPG
SCHEMBL12065255 0.87 SCN10A (0.40) SCN10AMLKLALPLALPIALPG
SCHEMBL14763112 0.85 FFAR1 (0.36) SCN10AMLKLPDE2A
SCHEMBL14774054 0.84 LMNA (0.34) MLKLALPLALPIALPGBRD4
SCHEMBL12066062 0.84 FFAR1 (0.44) IDO1SCN10A
SCHEMBL12066029 0.84 SCN10A (0.40) SCN10AMLKLPDE2A
SCHEMBL12065293 0.82 BRD4 (0.41) MLKLBRD4
SCHEMBL12066576 0.82 PDE2A (0.40) PDE2ABRD4
Phosphoric Acid SCHEMBL14763404 0.81 PDE2A (0.38) SCN10APDE2A

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 7 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 claimed
EP-2578573-A1 FUSED IMIDAZOLE DERIVATIVE TOA Eiyo Ltd. (JP) 2013-04-10 — — EP claimed
US-20130065896-A1 FUSED IMIDAZOLE DERIVATIVE TOA EIYO LTD. (JP) 2013-03-14 — — US claimed
US-9096531-B2 Fused imidazole derivative TOA EIYO LTD. (JP) 2015-08-04 — — US disclosed
EP-2578573-A1 FUSED IMIDAZOLE DERIVATIVE TOA Eiyo Ltd. (JP) 2013-04-10 — — EP disclosed
US-20130065896-A1 FUSED IMIDAZOLE DERIVATIVE TOA EIYO LTD. (JP) 2013-03-14 — — US disclosed
WO-2011148956-A1 FUSED IMIDAZOLE DERIVATIVE トーアエイヨー株式会社 (JP) 2011-12-01 — — 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-20130065896-A1 FUSED IMIDAZOLE DERIVATIVE CACNA1E, CACNA1G, CACNA1A IDO1 1108/4885SCN10A 85/4885MLKL 2378/4885

“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.

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