SCHEMBL29562010

SCHEMBL29562010

CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.62
PRSS1 P07477 1/20 0.62
CMA1 P23946 16/20 0.57
CTRC Q99895 2/20 0.54
ACE P12821 1/20 0.53
MAPK1 P28482 1/20 0.49

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
SCHEMBL29560799 1.00 F2 (0.62) F2PRSS1CMA1CTRCACE
SCHEMBL9815839 0.95 F2 (0.62) F2PRSS1CMA1CTRCACE
SCHEMBL9618661 0.91 CMA1 (0.58) F2PRSS1CMA1CTRCACE
SCHEMBL29445785 0.91 F2 (0.53) F2PRSS1CMA1CTRC
SCHEMBL7371676 0.90 F2 (0.64) F2PRSS1CMA1CTRCACE
SCHEMBL11013694 0.90 F2 (0.60) F2PRSS1CMA1CTRCACE
SCHEMBL11013687 0.90 F2 (0.60) F2PRSS1CMA1CTRCACE
SCHEMBL9601186 0.90 F2 (0.56) F2PRSS1CMA1CTRCACE
SCHEMBL22962005 0.88 F2 (0.58) F2PRSS1CMA1CTRCACE
SCHEMBL29934589 0.86 OPRM1 (0.58) F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115073587-B Synthesis process for synthesizing bivalirudin by semi-continuous liquid phase synthesis 厦门胜泽泰医药科技有限公司 2024-08-23 CN claimed
CN-115073587-A Synthesis process of semicontinuous liquid phase synthesis bivalirudin 厦门胜泽泰医药科技有限公司 2022-09-20 CN claimed
CN-112062835-B Preparation method of bivalirudin 扬子江药业集团四川海蓉药业有限公司 2022-04-26 CN claimed
CN-115073587-B Synthesis process for synthesizing bivalirudin by semi-continuous liquid phase synthesis 厦门胜泽泰医药科技有限公司 2024-08-23 CN disclosed
CN-117088966-A Synthesis method of bivalirudin impurity 江苏诺泰澳赛诺生物制药股份有限公司 2023-11-21 CN disclosed
CN-115073587-A Synthesis process of semicontinuous liquid phase synthesis bivalirudin 厦门胜泽泰医药科技有限公司 2022-09-20 CN disclosed
CN-112062835-B Preparation method of bivalirudin 扬子江药业集团四川海蓉药业有限公司 2022-04-26 CN disclosed
CN-112062835-B Preparation method of bivalirudin 扬子江药业集团四川海蓉药业有限公司 2022-04-26 CN disclosed