SCHEMBL7016637

SCHEMBL7016637

CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)OC(=O)CCNC(=O)[C@H](O)C(C)(C)CO

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.63
KCNH2 Q12809 1/20 0.63
VNN1 O95497 13/20 0.55
PRSS1 P07477 1/20 0.36
CTSG P08311 1/20 0.36
CTRB1 P17538 1/20 0.36
CMA1 P23946 1/20 0.36
ZDHHC20 Q5W0Z9 1/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL2458620 0.98 PTGS1 (0.61) PTGS1KCNH2VNN1PRSS1CTSG
SCHEMBL888201 0.98 PTGS1 (0.61) PTGS1KCNH2VNN1PRSS1CTSG
SCHEMBL10774486 0.98 PTGS1 (0.61) PTGS1KCNH2VNN1PRSS1CTSG
SCHEMBL25177991 0.94 PTGS1 (0.56) PTGS1KCNH2VNN1PRSS1CTSG
SCHEMBL11271120 0.94 PTGS1 (0.56) PTGS1KCNH2VNN1PRSS1CTSG
Pantothenic Acid SCHEMBL27275742 0.93 PTGS1 (0.55) PTGS1KCNH2VNN1PRSS1CTSG
SCHEMBL1261513 0.93 PTGS1 (0.55) PTGS1KCNH2VNN1PRSS1CTSG
SCHEMBL5939175 0.92 PTGS1 (0.58) PTGS1KCNH2VNN1PRSS1CTSG
SCHEMBL22551153 0.92 PTGS1 (0.58) PTGS1KCNH2VNN1PRSS1CTSG
SCHEMBL8428194 0.91 PTGS1 (0.56) PTGS1KCNH2VNN1ZDHHC20MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118236408-A Novel method for antagonizing toxicity of metalloid As based on magnetotactic bacteria AMB-1 中国科学院合肥物质科学研究院 2024-06-25 CN disclosed
CN-118185839-A Brevibacillus laterosporus for regulating and controlling pork quality, application thereof, compound strain and fattening pig feed 广东省农业科学院动物科学研究所 2024-06-14 CN disclosed
WO-2024058984-A2 METHODS AND USES OF MICROBIOME COMPOSITIONS, COMPONENTS, OR METABOLITES FOR TREATING INSULIN-ASSOCIATED DISEASES MarvelBiome, Inc. (US) 2024-03-21 WO disclosed
CN-117462625-A Application of traditional Chinese medicine composition in preparation of medicines for treating lung cancer 张程程 2024-01-30 CN disclosed
CN-115279387-A Topical composition comprising arillus longan combined crude drug extract for inhibiting TSLP and treating or improving skin inflammation diseases, and its application (株)美迪合伙来音 2022-11-01 CN disclosed
CN-110200134-A A kind of wood vinegar microorganism additive for farm animal feed and preparation method and application 谷峻峰 2019-09-06 CN disclosed
US-20190214145-A1 Method and systems for creating and screening patient metabolite profile to diagnose current medical condition, diagnose current treatment state and recommend new treatment regimen KUREK ITZHAK (US) 2019-07-11 US disclosed
CN-108077590-A Promote sow mammogenesis and improve the feed addictive of milk quality 大连海洋大学 2018-05-29 CN disclosed
CN-104480049-B It is a kind of to improve the yellowish pink selenium-rich lactobacillus preparation of Muscle of chicken and its application 天津农学院 2017-12-22 CN disclosed
CN-106417922-A Application of concentrated mineral drops (CMD) in respect of improving stress resistance of poultry 天津嘉洗乐生物科技有限公司 2017-02-22 CN disclosed
CN-1466447-A Packaged scalp cosmetic compositions 宝洁公司 2004-01-07 CN disclosed
CN-1128882-C Fermentation method for prepn. of D-pantothenic acid using strain of enterobacteriaceac DEGUSSA (DE) 2003-11-26 CN disclosed
CN-1447680-A Local release system of micronutrients and application thereof NIADYNE CORP (US) 2003-10-08 CN disclosed
EP-1322751-A2 GLUTARYL CEPHALOSPORIN AMIDASE FROM PSEUDOMONAS DIMINUTA BS-203 Bristol-Myers Squibb Company (US) 2003-07-02 EP disclosed
EP-1272157-A2 TOPICAL MICRONUTRIENT DELIVERY SYSTEM AND USES THEREOF Niadyne Corporation (US) 2003-01-08 EP disclosed
WO-2002024879-A2 GLUTARYL CEPHALOSPORIN AMIDASE FROM PSEUDOMONAS DIMINUTA BS-203 BRISTOL-MYERS SQUIBB COMPANY (US) 2002-03-28 WO disclosed
WO-2001078660-A2 TOPICAL MICRONUTRIENT DELIVERY SYSTEM AND USES THEREOF NIADYNE CORPORATION (US) 2001-10-25 WO disclosed
CN-1305365-A Leave-on hair compositions which contain diol PROCTER & GAMBLE (US) 2001-07-25 CN disclosed
CN-1259576-A Fermentation method for prepn. of D-pantothenic acid using strain of Enterobacteriaceac DEGUSSA (DE) 2000-07-12 CN disclosed
CN-1256314-A Fermentation process for preparing D-pantothenic acid by amplifying PAND gene in microbe DEGUSSA HULS GMBH (DE) 2000-06-14 CN disclosed