SCHEMBL16375196

SCHEMBL16375196

CN1CCc2cc(OC(F)F)cc(F)c2C1=O

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
AOC3 Q16853 2/20 0.36
DRD2 P14416 2/20 0.34
FPR1 P21462 3/20 0.33
FPR2 P25090 3/20 0.33
GAA P10253 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL16367610 0.84 HSD11B1 (0.35) FPR1FPR2
SCHEMBL28347181 0.80 SMN1; SMN2 (0.33) MEN1KMT2AFPR1FPR2SMN1; SMN2
SCHEMBL16375061 0.77 GPR119 (0.37) DRD2
SCHEMBL17664671 0.71 MEN1 (0.37) MEN1KMT2ADRD2GAASMN1; SMN2
SCHEMBL16346678 0.71 GPR52 (0.39) FPR1FPR2
SCHEMBL30550464 0.69 ACHE (0.39) MEN1KMT2AGAASMN1; SMN2
SCHEMBL17542683 0.67 ALDH1A1 (0.37) MEN1KMT2A
SCHEMBL19752740 0.66 MEN1 (0.37) MEN1KMT2AAOC3DRD2GAA
SCHEMBL7133599 0.65 CYP11B1 (0.51) KMT2A
SCHEMBL13139310 0.63 HTR2A (0.44) MEN1KMT2AGAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 MEN1 2984/4885KMT2A 1803/4885AOC3 1512/4885

“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.