SCHEMBL3140565

SCHEMBL3140565

CC(C)(C)OC(=O)NNC(=O)c1ccc(N2CCOCC2)cc1Cl

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.50
PKM P14618 1/20 0.48
PRKDC P78527 2/20 0.45
ALDH1A1 P00352 1/20 0.44
THRB P10828 1/20 0.43
BRD4 O60885 1/20 0.43
HTT P42858 2/20 0.42
MEN1 O00255 2/20 0.42
LMNA P02545 2/20 0.42
KMT2A Q03164 2/20 0.42
MCL1 Q07820 1/20 0.42
RAB9A P51151 2/20 0.42
CYP2C9 P11712 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ATM Q13315 1/20 0.41

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
SCHEMBL3143088 0.90 MEN1 (0.49) MAPTALDH1A1MEN1LMNAKMT2A
SCHEMBL3143629 0.89 MEN1 (0.48) MAPTALDH1A1MEN1LMNAKMT2A
SCHEMBL2089435 0.83 PRKDC (0.51) MAPTPKMPRKDCALDH1A1HTT
SCHEMBL2088134 0.81 MAPT (0.48) MAPTPRKDCHTTMEN1LMNA
SCHEMBL23032760 0.78 MAPT (0.50) MAPTPRKDCALDH1A1THRBBRD4
SCHEMBL20945305 0.78 ALDH1A1 (0.47) MAPTPKMALDH1A1HTTMEN1
SCHEMBL30595807 0.78 MAPT (0.50) MAPTPRKDCALDH1A1THRBBRD4
SCHEMBL2086265 0.77 PRKDC (0.55) MAPTPKMPRKDCALDH1A1HTT
SCHEMBL3133550 0.77 MAPT (0.56) MAPTPKMPRKDCTHRBHTT
SCHEMBL4890072 0.76 PRKDC (0.56) MAPTPKMPRKDCHTTMEN1

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
US-20100004221-A1 THIAZEPINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-01-07 US disclosed
EP-2119719-A1 THIAZEPINE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2009-11-18 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-20100004221-A1 THIAZEPINE DERIVATIVE HSD11B1, HSD17B1, HSD3B1 MAPT 4734/4885PKM 1696/4885PRKDC 2590/4885

“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.