Mirogabalin

Mirogabalin

SCHEMBL1816422

CCC1=C[C@@H]2[C@@H](C1)C[C@]2(CN)CC(=O)O

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CACNA2D1CACNA2D2

The experimentally established mechanism targets of Mirogabalin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CACNA2D1 known ✓ P54289 4/20 0.52
CACNB3 P54284 4/20 0.52
CACNA1C Q13936 4/20 0.52
AKR1B1 P15121 1/20 0.31
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 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
Mirogabalin SCHEMBL1888044 1.00 CACNB3 (0.52) CACNB3CACNA2D1CACNA1CAKR1B1CYP3A4
Mirogabalin SCHEMBL1814664 1.00 CACNB3 (0.52) CACNB3CACNA2D1CACNA1CAKR1B1CYP3A4
Mirogabalin SCHEMBL473853 1.00 CACNB3 (0.52) CACNB3CACNA2D1CACNA1CAKR1B1CYP3A4
Mirogabalin SCHEMBL1814663 1.00 CACNB3 (0.52) CACNB3CACNA2D1CACNA1CAKR1B1CYP3A4
Mirogabalin SCHEMBL18051452 1.00 CACNB3 (0.52) CACNB3CACNA2D1CACNA1CAKR1B1CYP3A4
Mirogabalin SCHEMBL18051438 1.00 CACNB3 (0.52) CACNB3CACNA2D1CACNA1CAKR1B1CYP3A4
Mirogabalin SCHEMBL1816421 1.00 CACNB3 (0.52) CACNB3CACNA2D1CACNA1CAKR1B1CYP3A4
Mirogabalin SCHEMBL1888046 1.00 CACNB3 (0.52) CACNB3CACNA2D1CACNA1CAKR1B1CYP3A4
SCHEMBL1880871 0.89 CACNB3 (0.42) CACNB3CACNA2D1CACNA1C
SCHEMBL1880872 0.89 CACNB3 (0.42) CACNB3CACNA2D1CACNA1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2192109-B1 BICYCLIC -AMINO ACID DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2013-09-04 EP claimed
US-20110130454-A1 PRODRUGS OF GAMMA-AMINO ACID, ALPHA-2-DELTA LIGANDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF XENOPORT, INC. (US) 2011-06-02 US claimed
US-7947738-B2 Bicyclic γ-amino acid derivative DAIICHI SANKYO COMPANY, LTD. (JP) 2011-05-24 US claimed
US-20100249229-A1 BICYCLIC gamma-AMINO ACID DERIVATIVE DAIICHI SANKYO COMPANY, LTD. (JP) 2010-09-30 US claimed
EP-2719677-B1 METHOD FOR PRODUCING BICYCLIC COMPOUND VIA CLAISEN REARRANGEMENT DAIICHI SANKYO CO LTD (JP) 2017-09-06 EP disclosed
EP-2837689-B1 OPTICAL RESOLUTION METHOD FOR BICYCLIC COMPOUND USING ENZYME DAIICHI SANKYO CO LTD (JP) 2017-02-15 EP disclosed
EP-2412700-B1 METHOD FOR PRODUCING BICYCLIC GAMMA-AMINO ACID DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2016-11-09 EP disclosed
US-9469623-B2 Preparation method for optically active bicyclic gamma-amino acid compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-10-18 US disclosed
EP-2871176-B1 PREPARATION METHOD FOR OPTICALLY ACTIVE BICYCLIC GAMMA-AMINO ACID DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2016-08-31 EP disclosed
US-9394235-B2 Optical resolution methods for bicyclic compounds using enzymes DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-07-19 US disclosed
US-9206104-B2 Methods for producing bicyclic compounds via iminium salt DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-12-08 US disclosed
US-9162971-B2 Methods for producing bicyclic compounds via claisen rearrangements DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-10-20 US disclosed
EP-2719676-A1 METHOD FOR PRODUCING BICYCLIC COMPOUND VIA IMINIUM SALT DAIICHI SANKYO COMPANY, LIMITED (JP) 2014-04-16 EP disclosed
EP-2192109-B1 BICYCLIC -AMINO ACID DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2013-09-04 EP disclosed
US-8324425-B2 Method for producing bicyclic γ-amino acid derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-12-04 US disclosed
US-20110130454-A1 PRODRUGS OF GAMMA-AMINO ACID, ALPHA-2-DELTA LIGANDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF XENOPORT, INC. (US) 2011-06-02 US disclosed
US-20110124705-A1 PRODRUGS OF ALPHA-2-DELTA LIGANDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF XENOPORT, INC. (US) 2011-05-26 US disclosed
US-7947738-B2 Bicyclic γ-amino acid derivative DAIICHI SANKYO COMPANY, LTD. (JP) 2011-05-24 US disclosed
US-20100249229-A1 BICYCLIC gamma-AMINO ACID DERIVATIVE DAIICHI SANKYO COMPANY, LTD. (JP) 2010-09-30 US disclosed
EP-2192109-A1 BICYCLIC -AMINO ACID DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2010-06-02 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 (3 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-20100249229-A1 BICYCLIC gamma-AMINO ACID DERIVATIVE GLRA2, GLRB, BCAT1 CACNA2D1 1728/4885CACNB3 1650/4885CACNA1C 717/4885
US-20110130454-A1 PRODRUGS OF GAMMA-AMINO ACID, ALPHA-2-DELTA LIGANDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF CHRND, CHRNE, OPRD1 CACNA2D1 1470/4885CACNB3 1544/4885CACNA1C 1159/4885
US-20110124705-A1 PRODRUGS OF ALPHA-2-DELTA LIGANDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF CHRND, CHRNE, CHRNG CACNA2D1 1091/4885CACNB3 1255/4885CACNA1C 966/4885

“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.