SCHEMBL16660257

SCHEMBL16660257

CC(C)CNc1cc(-c2cc(F)c(F)c(F)c2)ncn1

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 17/20 0.46
▸ HRH4 Q9H3N8 2/20 0.45
▸ MAPK14 Q16539 1/20 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
SCHEMBL15356577 0.85 FAAH (0.44) FAAHHRH4MAPK14
SCHEMBL15343420 0.83 FAAH (0.43) FAAHHRH4
SCHEMBL16660258 0.79 FAAH (0.51) FAAHHRH4
SCHEMBL15473118 0.79 FAAH (0.43) FAAHHRH4
SCHEMBL15356594 0.78 ESR1 (0.56) FAAHHRH4
SCHEMBL15343084 0.78 FAAH (0.46) FAAHHRH4
SCHEMBL3405987 0.78 FAAH (0.76) FAAH
SCHEMBL4294870 0.78 FAAH (0.76) FAAH
SCHEMBL15343058 0.78 PRKDC (0.47) FAAHHRH4
SCHEMBL15473058 0.77 FAAH (0.49) FAAHHRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150111871-A1 DNA-PK INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2015-04-23 — — 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-20150111871-A1 DNA-PK INHIBITORS POLK, DTYMK, DCK FAAH 3955/4885HRH4 2433/4885MAPK14 1675/4885

“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.

Send feedback