SCHEMBL2019434

SCHEMBL2019434

CC(C)CC1CC(=O)NC(=O)C1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.52
SMN1; SMN2 Q16637 4/20 0.50
NR2F2 P24468 4/20 0.50
ALDH1A1 P00352 3/20 0.50
LMNA P02545 3/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
HIF1A Q16665 2/20 0.50
TP53 P04637 2/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C19 P33261 1/20 0.50
MAPK1 P28482 1/20 0.50
CYP3A4 P08684 1/20 0.50
SLC2A1 P11166 1/20 0.50
EIF4A1 P60842 1/20 0.50
FKBP1A P62942 1/20 0.50
FKBP4 Q02790 1/20 0.50
EPAS1 Q99814 1/20 0.50
FKBP14 Q9NWM8 1/20 0.50
HTT P42858 1/20 0.50

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
SCHEMBL6871170 0.86 SMN1; SMN2 (0.41) CRBNSMN1; SMN2NR2F2ALDH1A1LMNA
SCHEMBL268203 0.78 TSHR (0.37) CRBNSMN1; SMN2NR2F2ALDH1A1LMNA
SCHEMBL21587611 0.78 TSHR (0.37) CRBNSMN1; SMN2NR2F2ALDH1A1LMNA
SCHEMBL522950 0.78 TSHR (0.37) CRBNSMN1; SMN2NR2F2ALDH1A1LMNA
SCHEMBL2691391 0.78
SCHEMBL102073 0.75 IRAK4 (0.35) CRBNSMN1; SMN2NR2F2ALDH1A1LMNA
SCHEMBL7082613 0.74 MAPT (0.60) SMN1; SMN2NR2F2ALDH1A1LMNANPC1
SCHEMBL886958 0.74 GLA (0.47) CRBNSMN1; SMN2NR2F2ALDH1A1LMNA
SCHEMBL22060611 0.74 SMN1; SMN2 (0.35) CRBNSMN1; SMN2NR2F2ALDH1A1LMNA
SCHEMBL29332040 0.74 SMN1; SMN2 (0.38) CRBNSMN1; SMN2NR2F2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119979516-A Dihydropyrimidinase mutant and application thereof in production of (R) -3- (carbamoylmethyl) -5-methylhexanoic acid 上海奥萝拉医药科技有限公司 2025-05-13 CN claimed
CN-119955872-A Synthetic protein of R- (-) -3- (carbamoylmethyl) -5-methylhexanoic acid, mutant and application thereof 中国科学院微生物研究所 2025-05-09 CN claimed
CN-119570777-A Preparation and application of immobilized hydantoin enzyme 宁波酶赛生物工程有限公司 2025-03-07 CN claimed
US-20250043323-A1 BIOCATALYSTS AND METHODS FOR THE SYNTHESIS OF PREGABALIN INTERMEDIATES Enzymaster (Ningbo) Bio-Engineering Co., Ltd (CN) 2025-02-06 US claimed
CN-114164198-B (R) - (-) -3- (carbamoylmethyl) -5-methylhexanoic acid synthetic protein, mutant and application thereof 中国科学院微生物研究所 2025-01-07 CN claimed
EP-4433602-A1 BIOCATALYSTS AND METHODS FOR THE SYNTHESIS OF PREGABALIN INTERMEDIATES Enzymaster (Ningbo) Bio-Engineering Co., Ltd. (CN) 2024-09-25 EP claimed
CN-113755539-B Dihydropyrimidine amino hydrolase and application thereof 杭州酶因生物技术有限公司 2024-05-28 CN claimed
CN-118064412-A Amidase, preparation method and application thereof 弈柯莱生物科技(集团)股份有限公司 2024-05-24 CN claimed
CN-114686465-B Synthesis method of hydrolase and (R) - (-) -3- (carbamoylmethyl) -5-methylhexanoic acid 宁波酶赛生物工程有限公司 2024-03-22 CN claimed
CN-117448309-A Preparation method of immobilized sea weed enzyme and application of immobilized sea weed enzyme in pregabalin intermediate 迪嘉药业集团股份有限公司 2024-01-26 CN claimed
CN-112521299-A Preparation method of pregabalin intermediate 内蒙古永太化学有限公司 2021-03-19 CN claimed
CN-112368262-A Method for preparing pregabalin intermediate (R) -3- (carbamoylmethyl) -5-methylhexanoic acid 浙江华海药业股份有限公司 2021-02-12 CN claimed
WO-2019232706-A1 METHOD FOR PREPARING PREGABALIN INTERMEDIATE (R)-3-(CARBAMOYLMETHYL)-5-METHYLHEXANOIC ACID 浙江华海药业股份有限公司 (CN) 2019-12-12 WO claimed
CN-105481712-A Racemization recycling method of Pregabalin intermediate mother liquor from resolution CHANGZHOU SUNLIGHT PHARM CO LTD 2016-04-13 CN claimed
CN-105001147-A Preparation method of Pregabalin intermediate impurity ZHEJIANG HUAHAI PHARM CO LTD 2015-10-28 CN claimed
CN-104496832-A Synthetic method of pregabalin ZHEJIANG MENOVO PHARMACEUTICALS CO LTD 2015-04-08 CN claimed
CN-104030936-A Method for preparing 3-carbamoylmethyl-5-methylhexanoic acid SHANGHAI ACEBRIGHT PHARMACEUTICAL CO LTD 2014-09-10 CN claimed
WO-2011077463-A1 PROCESS FOR PREPARING PREGABALIN AND ITS INTERMEDIATE MSN LABORATORIES LIMITED (IN) 2011-06-30 WO claimed
CN-100410242-C Pregabalin intermediate and process for preparing same JIANGSU NHWA PHARMACEUTICAL GR (CN) 2008-08-13 CN claimed
CN-1884263-A Pregabalin intermediate and process for preparing same JIANGSU NHWA PHARMACEUTICAL GR (CN) 2006-12-27 CN claimed