SCHEMBL16375197

SCHEMBL16375197

CN1CCc2cc(OC(F)(F)F)ccc2C1=O

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ AOC3 Q16853 2/20 0.55
▸ HRH3 Q9Y5N1 2/20 0.53
▸ GRM5 P41594 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ PRMT5 O14744 2/20 0.47
▸ WDR77 Q9BQA1 2/20 0.47
▸ CHRM5 P08912 4/20 0.44

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
SCHEMBL22693538 0.87 AOC3 (0.53) AOC3HRH3GRM5MEN1KMT2A
SCHEMBL8230310 0.83 AOC3 (0.53) AOC3HRH3GRM5MEN1KMT2A
SCHEMBL22693606 0.82 AOC3 (0.52) AOC3GRM5MEN1KMT2A
SCHEMBL16367611 0.82 PRMT5 (0.48) AOC3HRH3GRM5PRMT5WDR77
SCHEMBL2204112 0.82 MEN1 (0.62) AOC3GRM5MEN1KMT2A
SCHEMBL22693539 0.78 AOC3 (0.53) AOC3HRH3GRM5MEN1KMT2A
SCHEMBL16848201 0.77 AOC3 (0.49) AOC3HRH3PRMT5WDR77CHRM5
SCHEMBL14467156 0.77 CHRM5 (0.46) CHRM5
SCHEMBL30242535 0.75 GRM5 (0.56) AOC3HRH3GRM5MEN1KMT2A
SCHEMBL1239457 0.75 MAOB (0.60) HRH3GRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3016943-B1 HETEROARYL PYRIDONE AND AZA-PYRIDONE AMIDE COMPOUNDS HOFFMANN LA ROCHE (CH) 2019-08-21 — — EP disclosed
US-9326985-B2 Heteroaryl pyridone and aza-pyridone amide compounds GENENTECH, INC. (US) 2016-05-03 — — US disclosed
US-20150011461-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE AMIDE COMPOUNDS GENENTECH, INC. (US) 2015-01-08 — — US disclosed
WO-2015000949-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE AMIDE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2015-01-08 — — 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-20150011461-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE AMIDE COMPOUNDS BTK, TYK2, LCK AOC3 1512/4885HRH3 523/4885GRM5 1867/4885

“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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