SCHEMBL8420622

SCHEMBL8420622

CCN(CC)C(=O)/C=C(\C)c1cc(OCCc2ccccc2)cc(OCC(=O)O)c1

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 19/20 0.68
LTB4R2 Q9NPC1 19/20 0.68
PTGES O14684 1/20 0.43
ALOX5 P09917 1/20 0.43
PPARG P37231 1/20 0.43

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
SCHEMBL8420623 1.00 LTB4R (0.68) LTB4RLTB4R2PTGESALOX5PPARG
SCHEMBL8422187 0.90 LTB4R (0.56) LTB4RLTB4R2PTGESALOX5PPARG
SCHEMBL7989763 0.89 LTB4R (0.71) LTB4RLTB4R2
SCHEMBL7990289 0.89 LTB4R (0.71) LTB4RLTB4R2
SCHEMBL7990284 0.89 LTB4R (0.71) LTB4RLTB4R2
SCHEMBL8573084 0.83 LTB4R (0.81) LTB4RLTB4R2
SCHEMBL8420323 0.83 LTB4R (0.81) LTB4RLTB4R2
SCHEMBL8418927 0.83 LTB4R (0.81) LTB4RLTB4R2
SCHEMBL7977297 0.81 LTB4R (1.00) LTB4RLTB4R2
SCHEMBL7977292 0.81 LTB4R (1.00) LTB4RLTB4R2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0942903-A1 ARYL-SUBSTITUTED ACRYLAMIDES WITH LEUKOTRIENE B4 (LTB-4) RECEPTOR ANTAGONIST ACTIVITY Novartis AG (CH) 1999-09-22 EP disclosed
WO-1998013347-A1 ARYL-SUBSTITUTED ACRYLAMIDES WITH LEUKOTRIENE B4 (LTB-4) RECEPTOR ANTAGONIST ACTIVITY NOVARTIS AG (CH) 1998-04-02 WO disclosed