SCHEMBL3844471

SCHEMBL3844471

O=C(O)CNCC(Cc1ccccc1)N(CC(=O)O)CC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MME P08473 5/20 0.42
ACE P12821 3/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 1/20 0.42
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
ECE1 P42892 1/20 0.42
BLM P54132 1/20 0.42
NPEPPS P55786 1/20 0.42
KMT2A Q03164 1/20 0.42
OPRM1 P35372 4/20 0.41
OPRD1 P41143 4/20 0.41
OPRK1 P41145 4/20 0.41
KEAP1 Q14145 1/20 0.41
CPA3 P15088 1/20 0.41
MMP2 P08253 2/20 0.40
MAOB P27338 1/20 0.40
SLC15A1 P46059 1/20 0.40

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
SCHEMBL27404440 0.87 KDM4E (0.39) MAPTOPRM1OPRD1OPRK1MAOB
SCHEMBL22815248 0.85 OPRK1 (0.36) OPRM1OPRD1OPRK1MAOB
SCHEMBL22815229 0.85 OPRK1 (0.36) OPRM1OPRD1OPRK1MAOB
SCHEMBL10925267 0.78 MMP2 (0.59) MMEMMP2SLC15A1
SCHEMBL29505895 0.76 CYP1A2 (0.43) KEAP1CPA3MAOBSLC15A1CYP1A2
SCHEMBL233605 0.75 ALDH1A1 (0.31) ALDH1A1MAPT
SCHEMBL3311113 0.75 ALDH1A1 (0.31) ALDH1A1MAPT
SCHEMBL16656757 0.74 MAOB (0.48) HPGDMAPK1CPA3MAOBCYP1A2
SCHEMBL16656765 0.74 MAOB (0.48) HPGDMAPK1CPA3MAOBCYP1A2
SCHEMBL16656774 0.74 MAOB (0.48) HPGDMAPK1CPA3MAOBCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0668854-B1 USE OF N-ARYLMETHYLENE, ETHYLENEDIAMINETRIACETATES N-ARYLMETHYLENE IMINODIACETATES OR N,N'-DIARYLMETHYLENE ETHYLENEDIAMINACETATES FOR USE IN COMBATTING OXIDATIVE STRESS OREAL (FR) 1999-10-13 EP claimed
US-5703095-A PREVENTION FERRITIN FROM RELEASING OXYGEN L'OREAL (FR) 1997-12-30 US claimed
EP-1650214-B1 Silicon compound CHISSO CORP (JP) 2009-11-04 EP disclosed
US-7375170-B2 Organosilicon compound CHISSO CORPORATION (JP) 2008-05-20 US disclosed
EP-1849787-A1 Organosilicon compound Chisso Corporation (JP) 2007-10-31 EP disclosed
EP-1849788-A1 Organosilicon compound Chisso Corporation (JP) 2007-10-31 EP disclosed
US-7256243-B2 Silicon compound CHISSO CORPORATION (JP) 2007-08-14 US disclosed
US-20060175684-A1 Organosilicon compound JNC PETROCHEMICAL CORPORATION (JP) 2006-08-10 US disclosed
EP-1686133-A2 Organosilicon compound CHISSO CORPORATION (JP) 2006-08-02 EP disclosed
EP-1650214-A2 Silicon compound CHISSO CORPORATION (JP) 2006-04-26 EP disclosed
US-20050250925-A1 Silicon compound JNC CORPORATION (JP) 2005-11-10 US disclosed
US-4550071-A COLOR PHOTOGRAPHY ANTIFOGGING AGENTS; DIFFUSION TRANSFER FUJI PHOTO FILM. CO., LTD. (JP) 1985-10-29 US disclosed