SCHEMBL1503908

SCHEMBL1503908

CN(C)C(=O)[C@H]1CC[C@H](N)[C@H](NC(=O)O)C1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 2/20 0.33
▸ FASN P49327 3/20 0.33
▸ DPP4 P27487 1/20 0.32
▸ PDE7A Q13946 2/20 0.32
▸ GLI1 P08151 1/20 0.31
▸ MMP2 P08253 2/20 0.30
▸ MMP9 P14780 2/20 0.30
▸ CA12 O43570 2/20 0.30
▸ CA1 P00915 2/20 0.30
▸ CA2 P00918 2/20 0.30
▸ CA9 Q16790 2/20 0.30
▸ MMP1 P03956 1/20 0.30
▸ MMP3 P08254 1/20 0.30
▸ MMP8 P22894 1/20 0.30
▸ MMP13 P45452 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
SCHEMBL27903631 1.00 MME (0.33) MMEFASNDPP4PDE7AGLI1
Oxalic Acid SCHEMBL4114848 0.97 MME (0.32) MMEFASNDPP4PDE7A
Oxalic Acid SCHEMBL14908944 0.95 DPP4 (0.32) MMEFASNDPP4PDE7A
Sulfuric Acid SCHEMBL17472893 0.94 MME (0.31) MMEFASN
SCHEMBL20293628 0.89 MME (0.34) MMEFASNDPP4PDE7AGLI1
SCHEMBL20293481 0.89 MME (0.34) MMEFASNDPP4PDE7AGLI1
SCHEMBL20328936 0.87 FASN (0.38) MMEFASNMMP2MMP9MMP1
SCHEMBL31444622 0.85 BTK (0.36) —
SCHEMBL4632505 0.83 MME (0.33) MMEFASNDPP4PDE7AGLI1
SCHEMBL4632507 0.83 MME (0.33) MMEFASNDPP4PDE7AGLI1

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180179226-A1 Processes for the Preparation of Edoxaban and Intermediates Thereof THE BANK OF NOVA SCOTIA (CA) 2018-06-28 — — US disclosed
US-9809546-B2 Process for producing diamine derivative Chungwha Chemical Synthesis & Biotech Co., Ltd. (TW) 2017-11-07 — — US disclosed
US-20170260138-A1 PROCESS FOR PRODUCING DIAMINE DERIVATIVE CHUNGHWA CHEMICAL SYNTHESIS & BIOTECH CO. LTD. (TW) 2017-09-14 — — US disclosed
EP-2980067-B1 PROCESSES FOR PREPARING OPTICALLY ACTIVE DIAMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2017-05-17 — — EP disclosed
EP-1925611-B1 OPTICALLY ACTIVE DIAMINE DERIVATIVE AND PROCESS FOR PRODUCING THE SAME DAIICHI SANKYO CO LTD (JP) 2016-04-13 — — EP disclosed
EP-2980067-A1 PROCESSES FOR PREPARING OPTICALLY ACTIVE DIAMINE DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-02-03 — — EP disclosed
EP-1405852-B9 DIAMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2013-03-27 — — EP disclosed
EP-1405852-B1 DIAMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2012-08-01 — — EP disclosed
EP-1415992-B1 DIAMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2012-05-02 — — EP disclosed
US-20110312990-A1 Diamine Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-12-22 — — US disclosed
US-20090270446-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-10-29 — — US disclosed
US-20090105491-A1 OPTICALLY ACTIVE DIAMINE DERIVATIVE AND PROCESS FOR PRODUCING THE SAME DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-04-23 — — US disclosed
EP-1925611-A1 OPTICALLY ACTIVE DIAMINE DERIVATIVE AND PROCESS FOR PRODUCING THE SAME Daiichi Sankyo Company, Limited (JP) 2008-05-28 — — EP disclosed
US-7365205-B2 Cyclic diamine derivatives useful as agents for preventing and/or treating cerebral infarction, cerebral embolism, myocardial infarction, angina pectoris, pulmonary infarction, pulmonary embolism; inhibit activated blood coagulation factor X DAIICHI SANKYO COMPANY, LIMITED (JP) 2008-04-29 — — US disclosed
US-7342014-B2 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2008-03-11 — — US disclosed
US-20080015215-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2008-01-17 — — US disclosed
US-20050245565-A1 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-11-03 — — US disclosed
US-20050020645-A1 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-01-27 — — US disclosed
EP-1415992-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-05-06 — — EP disclosed
EP-1405852-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-04-07 — — 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 (8 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-20090270446-A1 DIAMINE DERIVATIVES F2, TFPI, F3 MME 171/4885FASN 4843/4885DPP4 113/4885
US-20090105491-A1 OPTICALLY ACTIVE DIAMINE DERIVATIVE AND PROCESS FOR PRODUCING THE SAME TFPI, F2, SERPINC1 MME 912/4885FASN 2979/4885DPP4 330/4885
US-20050020645-A1 Diamine derivatives C9, C1S, C1R MME 2012/4885FASN 1014/4885DPP4 3147/4885
US-20080015215-A1 DIAMINE DERIVATIVES C9, C1S, C1R MME 2012/4885FASN 1014/4885DPP4 3147/4885
US-20050245565-A1 Diamine derivatives C9, C1S, C1R MME 2012/4885FASN 1014/4885DPP4 3147/4885
US-20170260138-A1 PROCESS FOR PRODUCING DIAMINE DERIVATIVE DDT, ODC1, DDC MME 1255/4885FASN 1730/4885DPP4 1290/4885
US-20180179226-A1 Processes for the Preparation of Edoxaban and Intermediates Thereof VKORC1, CYP2C9, VKORC1L1 MME 2026/4885FASN 1917/4885DPP4 2271/4885
US-20110312990-A1 Diamine Derivatives C9, C1S, C1R MME 1985/4885FASN 1059/4885DPP4 3574/4885

“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.

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