SCHEMBL962372

SCHEMBL962372

CC(C)(C)OC(=O)Nc1cc(N2CCOCC2)cc(C=O)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 2/20 0.43
MAPT P10636 5/20 0.41
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
BRD4 O60885 2/20 0.41
KCNH2 Q12809 1/20 0.39
CD274 Q9NZQ7 1/20 0.37
MTOR P42345 3/20 0.36
PIK3CA P42336 4/20 0.36
AKT1 P31749 2/20 0.36
GAA P10253 1/20 0.36
GSK3B P49841 1/20 0.36
DYRK1A Q13627 1/20 0.36
PIK3CD O00329 1/20 0.36
PIK3CB P42338 1/20 0.36
PIK3CG P48736 1/20 0.36
POLB P06746 1/20 0.36
NPC1 O15118 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
SCHEMBL963106 0.85 TSHR (0.38) MAPTGSK3BDYRK1A
SCHEMBL12946506 0.82 KCNH2 (0.48) PRKDCMAPTLMNAKDM4EMEN1
SCHEMBL7016153 0.82 KCNH2 (0.48) PRKDCMAPTLMNAKDM4EMEN1
SCHEMBL7018611 0.80 PRKDC (0.41) PRKDCMAPTLMNAKDM4EMEN1
SCHEMBL961537 0.80 KCNH2 (0.51) PRKDCMAPTLMNAKDM4EMEN1
SCHEMBL961535 0.80 KCNH2 (0.51) PRKDCMAPTLMNAKDM4EMEN1
SCHEMBL7016739 0.79 PRKDC (0.41) PRKDCMAPTLMNAKDM4EMEN1
SCHEMBL7018612 0.79 KCNH2 (0.49) PRKDCMAPTLMNAKDM4EMEN1
SCHEMBL25776011 0.78 PRKDC (0.47) PRKDCMAPTLMNAKDM4EMEN1
SCHEMBL7016743 0.78 KCNH2 (0.48) PRKDCMAPTLMNAKDM4EMEN1

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-20110015181-A1 ALKYLAMINOPYRIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2011-01-20 US disclosed
EP-2264026-A1 ALKYLAMINOPYRIDINE DERIVATIVE Banyu Pharmaceutical Co., Ltd. (JP) 2010-12-22 EP disclosed
EP-0889034-B1 AMINOPYRIDINE DERIVATIVES BANYU PHARMA CO LTD (JP) 2003-09-17 EP disclosed
US-6011039-A USEFUL AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS; TREATING HYPERPHAGIA, OBESITY OR DIABETES BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-01-04 US disclosed
EP-0889034-A1 AMINOPYRIDINE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-01-07 EP 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-20110015181-A1 ALKYLAMINOPYRIDINE DERIVATIVE NPY4R, NPY1R, NPY2R PRKDC 4692/4885MAPT 4883/4885LMNA 3108/4885

“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.