SCHEMBL2785652

SCHEMBL2785652

CNC(=O)CC(C)CC(=O)NC

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.40
LMNA P02545 1/20 0.40
ATM Q13315 1/20 0.37
MAPT P10636 1/20 0.36
ALDH1A1 P00352 3/20 0.35
TDP1 Q9NUW8 1/20 0.35
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
SLC6A3 Q01959 1/20 0.32

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
SCHEMBL8183232 0.90 ALDH1A1 (0.45) MCL1LMNAATMMAPTALDH1A1
SCHEMBL14895499 0.88 ECE1 (0.35) MCL1LMNAATMMAPTALDH1A1
SCHEMBL13785286 0.87
SCHEMBL8564993 0.87
SCHEMBL6879131 0.87
SCHEMBL10117376 0.86 TSHR (0.39) MCL1LMNAATMMAPTALDH1A1
SCHEMBL1709120 0.86 MCL1 (0.32) MCL1LMNAATMMAPTALDH1A1
SCHEMBL15145452 0.85 MMP2 (0.40) MCL1LMNAMAPTALDH1A1TDP1
SCHEMBL20734740 0.85
SCHEMBL14532758 0.85 MMP2 (0.40) MCL1LMNAMAPTALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3778573-A1 COMPOUND WITH ANTICANCER ACTIVITY Kyowa Kirin Co., Ltd. (JP) 2021-02-17 EP disclosed
WO-2019189778-A1 COMPOUND WITH ANTICANCER ACTIVITY 協和発酵キリン株式会社 2019-10-03 WO disclosed
US-9834520-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-12-05 US disclosed
US-9834520-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-12-05 US disclosed
US-20160229814-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-08-11 US disclosed
US-20160229814-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-08-11 US disclosed
EP-2975031-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2016-01-20 EP disclosed
WO-2014142255-A1 HETEROCYCLIC COMPOUND 武田薬品工業株式会社 (JP) 2014-09-18 WO disclosed
US-8383745-B2 Method for producing N-methyl-N-vinylacetamide having improved stability and polymerizability SHOWA DENKO K.K. (JP) 2013-02-26 US disclosed
US-20110165112-A1 POLYMER CONJUGATES OF C-PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-07 US disclosed
US-20100280204-A1 METHOD FOR PRODUCING N-METHYL-N-VINYLACETAMIDE HAVING IMPROVED STABILITY AND POLYMERIZABILITY SHOWA DENKO K.K. (JP) 2010-11-04 US disclosed
EP-2239250-A1 METHOD FOR PRODUCING N-METHYL-N-VINYLACETAMIDE HAVING IMPROVED STABILITY AND POLYMERIZABILITY Showa Denko K.K. (JP) 2010-10-13 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 (2 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-20110165112-A1 POLYMER CONJUGATES OF C-PEPTIDES IAPP, GCG, INSR MCL1 2297/4885LMNA 1369/4885ATM 4843/4885
US-20160229814-A1 HETEROCYCLIC COMPOUND RORB, RORC, RORA MCL1 2629/4885LMNA 4161/4885ATM 4863/4885

“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.