SCHEMBL6546077

SCHEMBL6546077

CCCCCCCCCCC(CCCCCCCC)COCC(CCCCCCCC)CCCCCCCCCC.CCCCCCCCCCCC(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 8/20 0.64
PLA2G2C Q5R387 1/20 0.53
SLC6A5 Q9Y345 1/20 0.53
GLP1R P43220 8/20 0.52
PLA2G10 O15496 1/20 0.50
FAAH O00519 1/20 0.48

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
SCHEMBL6546068 1.00 NOD1 (0.64) NOD1PLA2G2CSLC6A5GLP1RPLA2G10
SCHEMBL29201432 0.89 NOD1 (0.60) NOD1PLA2G2CSLC6A5GLP1RPLA2G10
SCHEMBL9762130 0.88 NOD1 (0.55) NOD1PLA2G2CSLC6A5PLA2G10FAAH
SCHEMBL21838299 0.88 NOD1 (0.55) NOD1PLA2G2CSLC6A5PLA2G10FAAH
SCHEMBL21495973 0.88 NOD1 (0.55) NOD1PLA2G2CSLC6A5PLA2G10FAAH
SCHEMBL155010 0.88 NOD1 (0.55) NOD1PLA2G2CSLC6A5PLA2G10FAAH
SCHEMBL55274 0.88 NOD1 (0.82) NOD1PLA2G2CSLC6A5PLA2G10FAAH
SCHEMBL15650316 0.88 NOD1 (0.82) NOD1PLA2G2CSLC6A5PLA2G10FAAH
SCHEMBL539797 0.88 NOD1 (0.82) NOD1PLA2G2CSLC6A5PLA2G10FAAH
SCHEMBL15846211 0.88 NOD1 (0.82) NOD1PLA2G2CSLC6A5PLA2G10FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0830856-B1 Hair care compositions comprising higher alcohols and basic aminoacid derivatives AJINOMOTO KK (JP) 2004-01-28 EP disclosed
US-5968492-A SURFACTANTS FOR HAIR CONDITIONING USING AMINO ACIDS AND ALCOHOLS AND WASHING AJINOMOTO CO., INC. (JP) 1999-10-19 US disclosed
EP-0830856-A1 Hair care compositions comprising higher alcohols and basic aminoacid derivatives Ajinomoto Co., Ltd. (JP) 1998-03-25 EP disclosed