SCHEMBL8520097

SCHEMBL8520097

CCCC(=O)OC1CCCO1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.41
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
SLC18A3 Q16572 1/20 0.40
ALDH1A1 P00352 5/20 0.39
HPGD P15428 2/20 0.34
NLRP3 Q96P20 1/20 0.34
MAPT P10636 1/20 0.34
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL13614065 0.95 NAAA (0.44) NAAALMNAPOLBSLC18A3ALDH1A1
SCHEMBL27564579 0.91 ALDH1A1 (0.43) NAAASLC18A3ALDH1A1NLRP3
SCHEMBL26696399 0.90 NAAA (0.50) NAAALMNAPOLB
SCHEMBL26645777 0.89 ALDH1A1 (0.46) NAAALMNAPOLBALDH1A1HPGD
SCHEMBL2125922 0.85 CHRM2 (0.42) NAAALMNAPOLBALDH1A1HPGD
SCHEMBL28303143 0.85 CHRM2 (0.42) NAAALMNAPOLBALDH1A1HPGD
SCHEMBL26645767 0.85 LMNA (0.50) NAAALMNAPOLBALDH1A1HPGD
SCHEMBL10548119 0.85 LMNA (0.54) NAAALMNAPOLBALDH1A1HPGD
SCHEMBL3346305 0.85 NAAA (0.53) NAAALMNAPOLB
SCHEMBL6901495 0.83 NAAA (0.59) NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-11286482-A None JP disclosed
CN-117377653-A Branched tail lipid compounds and compositions for intracellular delivery of therapeutic agents 摩登纳特斯有限公司 2024-01-09 CN disclosed
CN-106397416-B A kind of preparation method of Tegafur 深圳万乐药业有限公司 2019-05-17 CN disclosed
CN-106397416-A Preparation method of tegafur 深圳万乐药业有限公司 2017-02-15 CN disclosed
CN-106336356-A POLYARYLENE MATERIALS 罗门哈斯电子材料有限责任公司 2017-01-18 CN disclosed
CN-106046329-A Polyarylene polymers 罗门哈斯电子材料有限责任公司 2016-10-26 CN disclosed
CN-105694005-A Silylated polyarylenes 罗门哈斯电子材料有限责任公司 2016-06-22 CN disclosed
CN-103044198-B A kind of method of BDO purifying co-producing tetrahydrofuran SINOPEC CORP. (CN) 2015-10-21 CN disclosed
CN-103159746-B A kind of method of industry law synthesis Tegafur SHANDONG NEW TIME PHARMACEUTICAL Co.,Ltd. (CN) 2015-09-02 CN disclosed
CN-103044197-B Technological method for purifying1,4-butanediol and co-producing gamma-butyrolactone CHINA PETROLEUM & CHEMICAL 2015-07-22 CN disclosed
JP-H11286482-A PURIFICATION OF GAMMA-BUTYROLACTONE TONEN CORP 1999-10-19 JP disclosed