SCHEMBL17490336

SCHEMBL17490336

CC(O)(c1ccccn1)C1CCC1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CHRM3 P20309 4/20 0.44
CHRM2 P08172 4/20 0.44
MEN1 O00255 4/20 0.40
KMT2A Q03164 3/20 0.40
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 1/20 0.38
NR3C1 P04150 1/20 0.38
AHR P35869 1/20 0.37
ATM Q13315 1/20 0.36
GRM5 P41594 1/20 0.36
ABHD6 Q9BV23 1/20 0.35
DAGLA Q9Y4D2 1/20 0.35
NPY2R P49146 1/20 0.35
ALDH1A1 P00352 1/20 0.35
BLM P54132 1/20 0.35

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
SCHEMBL17490363 0.97 L3MBTL1 (0.50) L3MBTL1SMN1; SMN2CHRM3CHRM2MEN1
SCHEMBL16132528 0.95 SMN1; SMN2 (0.48) L3MBTL1SMN1; SMN2CHRM3CHRM2MEN1
SCHEMBL17490358 0.93 SMN1; SMN2 (0.53) L3MBTL1SMN1; SMN2CHRM3CHRM2MEN1
SCHEMBL16132356 0.83 SMN1; SMN2 (0.47) L3MBTL1SMN1; SMN2CHRM3CHRM2MEN1
SCHEMBL16132365 0.80 SMN1; SMN2 (0.47) L3MBTL1SMN1; SMN2CHRM3CHRM2MEN1
SCHEMBL21742299 0.79 SMN1; SMN2 (0.41) L3MBTL1SMN1; SMN2CHRM3CHRM2MEN1
SCHEMBL21742307 0.79 SMN1; SMN2 (0.41) L3MBTL1SMN1; SMN2CHRM3CHRM2MEN1
SCHEMBL21742263 0.79 SMN1; SMN2 (0.46) L3MBTL1SMN1; SMN2CHRM3CHRM2MEN1
SCHEMBL16132530 0.79 SMN1; SMN2 (0.46) L3MBTL1SMN1; SMN2CHRM3CHRM2MEN1
SCHEMBL21742194 0.77 SMN1; SMN2 (0.47) L3MBTL1SMN1; SMN2CHRM3CHRM2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3611164-A1 PYRIDONE COMPOUND, AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT Mitsui Chemicals Agro, Inc. (JP) 2020-02-19 EP disclosed
US-20160031868-A1 BENZIMIDAZOLONE DERIVATIVES AS BROMODOMAIN INHIBITORS GILEAD SCIENCES, INC. 2016-02-04 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-20160031868-A1 BENZIMIDAZOLONE DERIVATIVES AS BROMODOMAIN INHIBITORS BRD4, BRD3, BRD1 L3MBTL1 1346/4885SMN1; SMN2 3186/4885CHRM3 2978/4885

“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.