SCHEMBL2059690

SCHEMBL2059690

CC(C)([C]=O)C(C)(C)C(N)=O

nearest known ligand 0.30

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.30
ALOX15 P16050 1/20 0.30
BLM P54132 1/20 0.30
PMP22 Q01453 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL9906255 0.76 MCL1 (0.31)
SCHEMBL4152740 0.75 LMNA (0.43) LMNAALOX15BLMPMP22MAPT
SCHEMBL1267363 0.71
SCHEMBL1090931 0.69 LMNA (0.38) LMNAALOX15BLMPMP22MAPT
SCHEMBL668141 0.67
SCHEMBL25917062 0.67 LMNA (0.35) LMNAALOX15BLMPMP22MAPT
SCHEMBL22788847 0.67 LMNA (0.30) LMNAALOX15BLMPMP22MAPT
SCHEMBL15128371 0.65 LMNA (0.33) LMNAALOX15BLMPMP22MAPT
SCHEMBL11050625 0.65 TSHR (0.42) LMNAALOX15BLMPMP22MAPT
SCHEMBL17550605 0.65 LMNA (0.41) LMNAALOX15BLMPMP22MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107686455-A N-octadecyl ethylimidonate methyl ester and synthetic method thereof 中国石油天然气股份有限公司 2018-02-13 CN disclosed
CN-107473985-A N-hexadecyl ethylimido acid methyl ester and synthetic method thereof 中国石油天然气股份有限公司 2017-12-15 CN disclosed
CN-107473984-A N-tetradecyl ethylimidonate methyl ester and synthetic method thereof 中国石油天然气股份有限公司 2017-12-15 CN disclosed
CN-107473983-A N-dodecyl methyl ethylimidoate and synthetic method thereof 中国石油天然气股份有限公司 2017-12-15 CN disclosed
US-9045484-B2 Inhibitors of the BMP signaling pathway THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2015-06-02 US disclosed
EP-2265603-B1 INHIBITORS OF THE BMP SIGNALING PATHWAY GEN HOSPITAL CORP (US) 2014-05-07 EP disclosed
US-20140011805-A1 INHIBITORS OF THE BMP SIGNALING PATHWAY THE BRIGHAM AND WOMEN'S HOSPITAL, INC. 2014-01-09 US disclosed
US-8507501-B2 Inhibitors of the BMP signaling pathway THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2013-08-13 US disclosed
US-20110053930-A1 INHIBITORS OF THE BMP SIGNALING PATHWAY THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2011-03-03 US disclosed
EP-2265603-A1 INHIBITORS OF THE BMP SIGNALING PATHWAY The General Hospital Corporation (US) 2010-12-29 EP disclosed
WO-2009114180-A1 INHIBITORS OF THE BMP SIGNALING PATHWAY THE GENERAL HOSPITAL CORPORATION (US) 2009-09-17 WO disclosed
EP-1332132-A2 ENAMINE DERIVATIVES AS CELL ADHESION MOLECULES Celltech R&D Limited (GB) 2003-08-06 EP disclosed
EP-1286995-A1 2,7-NAPHTHYRIDINE DERIVATIVES Celltech R&D Limited (GB) 2003-03-05 EP disclosed
WO-2001092256-A1 2,7-NAPHTHYRIDINE DERIVATIVES CELLTECH R & D LIMITED (GB) 2001-12-06 WO disclosed
WO-2001079173-A2 ENAMINE DERIVATIVES AS CELL ADHESION MOLECULES CELLTECH R & D LIMITED (GB) 2001-10-25 WO disclosed
EP-0827495-A4 SUBSTITUTED-PENT-4-YNOIC ACIDS SMITHKLINE BEECHAM CORP (US) 1998-11-04 EP disclosed
EP-0827495-A1 SUBSTITUTED-PENT-4-YNOIC ACIDS SMITHKLINE BEECHAM CORPORATION (US) 1998-03-11 EP disclosed
WO-1997003945-A1 SUBSTITUTED-PENT-4-YNOIC ACIDS SMITHKLINE BEECHAM CORPORATION (US) 1997-02-06 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 (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-20110053930-A1 INHIBITORS OF THE BMP SIGNALING PATHWAY BMP1, BMP2K, BMP2 LMNA 1922/4885ALOX15 2494/4885BLM 3969/4885
US-20140011805-A1 INHIBITORS OF THE BMP SIGNALING PATHWAY BMP1, BMP2K, BMP2 LMNA 1922/4885ALOX15 2494/4885BLM 3969/4885

“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.