SCHEMBL15565304

SCHEMBL15565304

CCOC(=O)C(N(Cc1ccccc1)Cc1ccccc1)C1(O)CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.48
CHRM2 P08172 2/20 0.46
CHRM1 P11229 2/20 0.46
CHRM3 P20309 2/20 0.46
CHRM4 P08173 1/20 0.46
LMNA P02545 3/20 0.45
ALDH1A1 P00352 3/20 0.45
POLB P06746 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TP53 P04637 3/20 0.44
MAPT P10636 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
TRPM8 Q7Z2W7 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MMP8 P22894 1/20 0.39

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
SCHEMBL22893643 0.88 OPRM1 (0.51) L3MBTL1LMNAALDH1A1POLBHSD17B10
SCHEMBL15565306 0.84 CHRM2 (0.40) CHRM2CHRM1CHRM3CHRM4LMNA
SCHEMBL20487147 0.82 L3MBTL1 (0.42) L3MBTL1LMNAALDH1A1POLBHSD17B10
SCHEMBL20488330 0.81 JAK2 (0.46) L3MBTL1ALDH1A1POLBSMN1; SMN2
SCHEMBL20487581 0.81 JAK2 (0.46) L3MBTL1ALDH1A1POLBSMN1; SMN2
SCHEMBL25663657 0.75 SLC6A2 (0.40) CHRM2CHRM1CHRM3CHRM4LMNA
SCHEMBL11165873 0.73 L3MBTL1 (0.59) L3MBTL1LMNAALDH1A1POLBHSD17B10
SCHEMBL6363989 0.73 L3MBTL1 (0.59) L3MBTL1LMNAALDH1A1POLBHSD17B10
SCHEMBL25663636 0.73 SIGMAR1 (0.40) CHRM2CHRM1CHRM3LMNAALDH1A1
SCHEMBL3632576 0.72 L3MBTL1 (0.54) L3MBTL1LMNAALDH1A1POLBHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9394263-B2 Substituted hetero-azepinones F. HOFFMANN-LA ROCHE AG (CH) 2016-07-19 US disclosed
US-20150361059-A1 SUBSTITUTED HETERO-AZEPINONES HOFFMAN-LA ROCHE INC. (US) 2015-12-17 US disclosed
EP-2882725-A1 SUBSTITUTED HETERO-AZEPINONES F. Hoffmann-La Roche AG (CH) 2015-06-17 EP disclosed
CN-104470905-A Substituted hetero-azepinones HOFFMANN LA ROCHE 2015-03-25 CN disclosed
WO-2014023708-A1 SUBSTITUTED HETERO-AZEPINONES F. HOFFMANN-LA ROCHE AG (CH) 2014-02-13 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-20150361059-A1 SUBSTITUTED HETERO-AZEPINONES CCNY, CCNE1, CCND3 L3MBTL1 1802/4885CHRM2 701/4885CHRM1 368/4885

“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.