SCHEMBL29101090

SCHEMBL29101090

N[C@H](Cc1ccc(CCl)cc1)C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 3/20 0.69
PTGS1 P23219 3/20 0.68
ALPI P09923 1/20 0.68
PKM P14618 1/20 0.68
XIAP P98170 1/20 0.68
HIF1A Q16665 5/20 0.63
CYP3A4 P08684 3/20 0.63
ALOX15 P16050 3/20 0.63
ALDH1A1 P00352 2/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
TDP1 Q9NUW8 2/20 0.63
KDM4E B2RXH2 2/20 0.63
ABCB11 O95342 1/20 0.63
CHRM2 P08172 1/20 0.63
ADRA2A P08913 1/20 0.63
CHRM1 P11229 1/20 0.63
ACHE P22303 1/20 0.63
OPRM1 P35372 1/20 0.63
DRD3 P35462 1/20 0.63
SLC6A3 Q01959 1/20 0.63

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
SCHEMBL2779304 1.00 SLC7A5 (0.69) SLC7A5PTGS1ALPIPKMXIAP
SCHEMBL2779299 1.00 SLC7A5 (0.69) SLC7A5PTGS1ALPIPKMXIAP
SCHEMBL2310526 0.89 SLC7A5 (0.83) SLC7A5PTGS1ALPIPKMXIAP
Phenylalanine SCHEMBL7110128 0.86 SLC7A5 (0.65) SLC7A5PTGS1ALPIPKMXIAP
SCHEMBL25386492 0.84 SLC7A5 (0.57) SLC7A5PTGS1ALPIPKMXIAP
Fenclonine SCHEMBL3140768 0.84 SLC7A5 (0.69) SLC7A5PTGS1ALPIPKMXIAP
Fenclonine SCHEMBL245828 0.84 SLC7A5 (0.69) SLC7A5PTGS1ALPIPKMXIAP
SCHEMBL25386493 0.84 SLC7A5 (0.57) SLC7A5PTGS1ALPIPKMXIAP
Fenclonine SCHEMBL26383 0.84 SLC7A5 (0.69) SLC7A5PTGS1ALPIPKMXIAP
Fenclonine SCHEMBL26382 0.84 SLC7A5 (0.69) SLC7A5PTGS1ALPIPKMXIAP

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
CN-117820737-B Preparation method of anti-skid and anti-penetration sole material 惠州市圣邦鞋业有限公司 2024-10-25 CN claimed
CN-117820737-A Preparation method of anti-skid and anti-penetration sole material 苏州市明家顺纺织有限公司 2024-04-05 CN claimed
CN-116574319-B Anti-skid and anti-penetration sole material and preparation method thereof 安新县亚特兰鞋业有限公司 2023-12-26 CN claimed
CN-116574319-A Anti-skid and anti-penetration sole material and preparation method thereof 苏州市明家顺纺织有限公司 2023-08-11 CN claimed
CN-117820737-B Preparation method of anti-skid and anti-penetration sole material 惠州市圣邦鞋业有限公司 2024-10-25 CN disclosed
CN-117820737-A Preparation method of anti-skid and anti-penetration sole material 苏州市明家顺纺织有限公司 2024-04-05 CN disclosed
CN-117820737-A Preparation method of anti-skid and anti-penetration sole material 苏州市明家顺纺织有限公司 2024-04-05 CN disclosed
CN-116574319-B Anti-skid and anti-penetration sole material and preparation method thereof 安新县亚特兰鞋业有限公司 2023-12-26 CN disclosed
CN-116574319-B Anti-skid and anti-penetration sole material and preparation method thereof 安新县亚特兰鞋业有限公司 2023-12-26 CN disclosed
CN-116574319-A Anti-skid and anti-penetration sole material and preparation method thereof 苏州市明家顺纺织有限公司 2023-08-11 CN disclosed
CN-116574319-A Anti-skid and anti-penetration sole material and preparation method thereof 苏州市明家顺纺织有限公司 2023-08-11 CN disclosed