SCHEMBL23923952

SCHEMBL23923952

COC(=O)C(C)N(C(=O)C(N)CC(=O)O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.42
MEN1 O00255 2/20 0.42
PLA2G1B P04054 1/20 0.42
HTT P42858 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ATG4B Q9Y4P1 1/20 0.42
LTA4H P09960 3/20 0.42
ALDH1A1 P00352 2/20 0.39
LMNA P02545 2/20 0.39
TP53 P04637 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ESRRB O95718 1/20 0.38
CHRNB2 P17787 1/20 0.37
CHRNB4 P30926 1/20 0.37
CHRNA3 P32297 1/20 0.37
CHRNA4 P43681 1/20 0.37
KIF11 P52732 1/20 0.36
MAPT P10636 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PTGS1 P23219 1/20 0.35

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
SCHEMBL421787 1.00 KMT2A (0.42) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL10533268 0.91 KCNA5 (0.42) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL9514133 0.88 MEN1 (0.43) KMT2AMEN1ALDH1A1LMNATP53
Aspartame SCHEMBL2107955 0.86 ALDH1A1 (0.52) ALDH1A1LMNA
SCHEMBL6690977 0.86 ALDH1A1 (0.43) LTA4HALDH1A1LMNATP53SMN1; SMN2
SCHEMBL1434038 0.86 ALDH1A1 (0.43) LTA4HALDH1A1LMNATP53SMN1; SMN2
SCHEMBL11235723 0.84 CASP1 (0.38) ALDH1A1LMNATP53SMN1; SMN2
SCHEMBL11122333 0.82 KMT2A (0.39) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL7537846 0.81 KMT2A (0.36) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL10743692 0.81 KMT2A (0.42) KMT2AMEN1PLA2G1BHTTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4132476-A1 RHEOLOGICAL SOLID ORAL COMPOSITION The Procter & Gamble Company (US) 2023-02-15 EP disclosed
US-20210322322-A1 RHEOLOGICAL SOLID ORAL COMPOSITION THE PROCTER & GAMBLE COMPANY 2021-10-21 US disclosed
CN-110478269-A Toothpaste with high salt with stable viscosity COLGATE PALMOLIVE CO 2019-11-22 CN disclosed
CN-105934238-B Toothpaste with the rheology modifier based on alginates 高露洁-棕榄公司 2019-11-19 CN disclosed
CN-105792896-B Two parts oxidation system for oral care composition 高露洁-棕榄公司 2019-08-13 CN disclosed
CN-109890354-A oral care compositions and methods of use 高露洁-棕榄公司 2019-06-14 CN disclosed
CN-104983593-B Dentifrice composition with reduced astringency 高露洁-棕榄公司 2018-11-20 CN disclosed
CN-105722554-B Tooth clear coat composition and its application method 高露洁-棕榄公司 2018-09-14 CN disclosed
CN-108348432-A oral composition 三仪股份有限公司 2018-07-31 CN disclosed
CN-107106422-A High salt toothpaste and its application method 高露洁-棕榄公司 2017-08-29 CN disclosed
CN-107072935-A Composition for toothpaste 三仪股份有限公司 2017-08-18 CN disclosed
CN-104736127-B oral composition 三仪股份有限公司 2017-06-13 CN disclosed
CN-105935121-A Sweetened consumables and methods of forming said sweetened consumables 奇华顿股份有限公司 2016-09-14 CN disclosed
CN-105934238-A Toothpaste with alginate base rheology modifier 高露洁-棕榄公司 2016-09-07 CN disclosed
CN-101784201-A Consumer product GIVAUDAN SA 2010-07-21 CN disclosed
CN-100429993-C Composition with enhanced water solubility and method of making the same PROCTER & GAMBLE (US) 2008-11-05 CN disclosed
CN-1507324-A Compositions with high intensity sweetener having enhanced aqueous solubility and methods of their preparation 2004-06-23 CN disclosed