SCHEMBL7989763

SCHEMBL7989763

CCN(CC)C(=O)/C=C(\C)c1cc(OCC(=O)O)cc(OCc2ccccc2)c1

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 18/20 0.71
LTB4R2 Q9NPC1 18/20 0.71
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
MAOB P27338 1/20 0.46

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
SCHEMBL7990289 1.00 LTB4R (0.71) LTB4RLTB4R2MEN1KMT2AMAOB
SCHEMBL7990284 1.00 LTB4R (0.71) LTB4RLTB4R2MEN1KMT2AMAOB
SCHEMBL8420622 0.89 LTB4R (0.68) LTB4RLTB4R2
SCHEMBL8420623 0.89 LTB4R (0.68) LTB4RLTB4R2
SCHEMBL7988639 0.86 LTB4R (0.73) LTB4RLTB4R2MAOB
SCHEMBL7990401 0.86 LTB4R (0.73) LTB4RLTB4R2MAOB
SCHEMBL7990405 0.86 LTB4R (0.73) LTB4RLTB4R2MAOB
SCHEMBL7988633 0.86 LTB4R (0.73) LTB4RLTB4R2MAOB
SCHEMBL7990403 0.86 LTB4R (0.73) LTB4RLTB4R2MAOB
SCHEMBL7988629 0.86 LTB4R (0.73) LTB4RLTB4R2MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6291530-B1 Aryl-substituted acrylamides with Leukotriene B4 (LTB-4) receptor antagonist activity NOVARTIS AG (CH) 2001-09-18 US disclosed
US-6207686-B1 FOR THERAPY OF HYPERTENSION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-03-27 US disclosed
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
WO-1996015109-A1 ENDOTHELIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-05-23 WO disclosed