SCHEMBL7769540

SCHEMBL7769540

CCCCCCCCCCCCNC(C(=O)O)C(O)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.47
GPR84 Q9NQS5 3/20 0.46
FFAR1 O14842 1/20 0.46
EPHX1 P07099 8/20 0.44
PLA2G2A P14555 1/20 0.42
PLA2G5 P39877 1/20 0.42
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
NAAA Q02083 2/20 0.41
MAPT P10636 1/20 0.40
CASP2 P42575 1/20 0.40
LCK P06239 1/20 0.40
PPARD Q03181 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
NOD1 Q9Y239 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
SCHEMBL7765604 1.00 SMN1; SMN2 (0.47) SMN1; SMN2GPR84FFAR1EPHX1PLA2G2A
SCHEMBL17292139 0.92 SMN1; SMN2 (0.42) SMN1; SMN2GPR84FFAR1EPHX1PLA2G2A
SCHEMBL28120497 0.91 SMN1; SMN2 (0.41) SMN1; SMN2GPR84FFAR1EPHX1PLA2G2A
SCHEMBL5363820 0.86 SMN1; SMN2 (0.55) SMN1; SMN2GPR84FFAR1EPHX1PLA2G2A
SCHEMBL27850913 0.85 SMN1; SMN2 (0.51) SMN1; SMN2GPR84FFAR1EPHX1PLA2G2A
SCHEMBL28346801 0.84 SMN1; SMN2 (0.50) SMN1; SMN2GPR84FFAR1EPHX1PLA2G2A
SCHEMBL11581198 0.83 SMN1; SMN2 (0.62) SMN1; SMN2GPR84FFAR1EPHX1PLA2G2A
SCHEMBL2286586 0.83 SMN1; SMN2 (0.53) SMN1; SMN2GPR84FFAR1EPHX1PLA2G2A
SCHEMBL28439323 0.83 SMN1; SMN2 (0.62) SMN1; SMN2GPR84FFAR1EPHX1PLA2G2A
SCHEMBL11581195 0.83 SMN1; SMN2 (0.62) SMN1; SMN2GPR84FFAR1EPHX1PLA2G2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0721446-B1 CHIRAL SURFACTANTS AND METHODS FOR THEIR USE IN CHIRAL SEPARATIONS WATERS CORP (US) 2001-07-18 EP disclosed