⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL268147 | 1.00 | — | — | |
| SCHEMBL4740330 | 0.85 | TSHR (0.41) | — | |
| SCHEMBL15310039 | 0.85 | TSHR (0.33) | — | |
| SCHEMBL8818203 | 0.83 | TSHR (0.35) | — | |
| SCHEMBL13186335 | 0.82 | TSHR (0.32) | — | |
| SCHEMBL19729650 | 0.82 | TSHR (0.32) | — | |
| SCHEMBL14216330 | 0.82 | TSHR (0.32) | — | |
| Ammonia Solution, Strong SCHEMBL27805104 | 0.82 | TSHR (0.39) | — | |
| SCHEMBL14586670 | 0.81 | TSHR (0.39) | — | |
| SCHEMBL17190879 | 0.79 | — | — |
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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8304252-B2 | Stereoselective bioconversion of aliphatic dinitriles into cyano carboxylic acids | PFIZER INC. (US) | 2012-11-06 | — | — | US | disclosed |
| US-8212071-B2 | Asymmetric synthesis of (S)-(+)-3-(aminomethyl)-5-methylhexanoic acid | TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) | 2012-07-03 | — | — | US | disclosed |
| US-8168828-B2 | Process for the preparation of pregabalin | MSN LABORATORIES, LIMITED (IN) | 2012-05-01 | — | — | US | disclosed |
| US-8134023-B2 | Preparation of pregabalin and related compounds | PFIZER INC (US) | 2012-03-13 | — | — | US | disclosed |
| US-20120015412-A1 | Preparation of Pregabalin and Related Compounds | PFIZER INC | 2012-01-19 | — | — | US | disclosed |
| US-8097754-B2 | Synthesis of (S)-(+)-3-(aminomethyl)-5-methyl hexanoic acid | TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) | 2012-01-17 | — | — | US | disclosed |
| US-8044227-B2 | Preparation of pregabalin and related compounds | PFIZER INC. (US) | 2011-10-25 | — | — | US | disclosed |
| US-7960583-B2 | Asymmetric synthesis of (S)-(+)-3-(aminomethyl)-5-methylhexanoic acid | TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) | 2011-06-14 | — | — | US | disclosed |
| US-7923575-B2 | Asymmetric synthesis of (S)-(+)-3-(aminomethyl)-5-methylhexanoic acid | TEVA PHARMACEUTICAL INDUSTRIES LIMITED (IL) | 2011-04-12 | — | — | US | disclosed |
| US-20110065168-A1 | Preparation of Pregabalin and Related Compounds | PFIZER INC | 2011-03-17 | — | — | US | disclosed |
| US-7470812-B2 | Chiral 3-carbamoylmethyl-5-methyl hexanoic acids, key intermediates for the synthesis of (S)-Pregabalin | TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) | 2008-12-30 | — | — | US | disclosed |
| US-7465826-B2 | Chiral 3-carbamoylmethyl-5-methyl hexanoic acids, key intermediates for the synthesis of (S)-pregabalin | TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) | 2008-12-16 | — | — | US | disclosed |
| US-20080306292-A1 | Synthesis of (S)-(+)-3-(aminomethyl)-5-methyl hexanoic acid | TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) | 2008-12-11 | — | — | US | disclosed |
| US-7446220-B2 | Asymmetric synthesis of (S)-(+)-3-(aminomethyl)-5-methylhexanoic acid | TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) | 2008-11-04 | — | — | US | disclosed |
| US-20080051602-A1 | Chiral 3-carbamoylmethyl-5-methyl hexanoic acids, key intermediates for the synthesis of (S)-Pregabalin | KANSAL VINOD K | 2008-02-28 | — | — | US | disclosed |
| US-20080045747-A1 | Chiral 3-carbamoylmethyl-5-methyl hexanoic acids, key intermediates for the synthesis of (S)-pregabalin | KANSAL VINOD K | 2008-02-21 | — | — | US | disclosed |
| US-20070197827-A1 | Novel asymmetric synthesis of (S)-(+)-3-(aminomethyl)-5-methylhexanoic acid | TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) | 2007-08-23 | — | — | US | disclosed |
| US-20070196905-A1 | Stereoselective bioconversion of aliphatic dinitriles into cyano carboxylic acids | PFIZER INC. | 2007-08-23 | — | — | US | disclosed |
| US-20070191636-A1 | Chiral 3-carbamoylmethyl-5-methyl hexanoic acids, key intermediates for the synthesis of (S)-Pregabalin | TEVA PHARMACEUTICAL USA, INC. | 2007-08-16 | — | — | US | disclosed |
| US-20070066846-A1 | Process for making (S)-Pregabalin | TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) | 2007-03-22 | — | — | US | disclosed |