SCHEMBL2488907

SCHEMBL2488907

Cc1ccccc1-c1ccc(C(=O)NC2(C(=O)O)CCCCC2)nc1-c1ccc(Cl)c(OCCCN(C)C)c1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 3/20 0.39
KDM4E B2RXH2 3/20 0.38
ATM Q13315 2/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
PAICS P22234 2/20 0.36
SLC6A9 P48067 1/20 0.36
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
PDE5A O76074 1/20 0.34
PDE4D Q08499 1/20 0.34
PDE7A Q13946 1/20 0.34
KDR P35968 1/20 0.34
CTSA P10619 1/20 0.34

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
Hydrochloric Acid SCHEMBL544080 0.99 LPAR1 (0.38) LPAR1KDM4EATMMAPTMAPK1
Hydrochloric Acid SCHEMBL544865 0.99 LPAR1 (0.38) LPAR1KDM4EATMMAPTMAPK1
SCHEMBL913389 0.94 DGAT2 (0.35) LPAR1KDM4EATMMAPTMAPK1
Hydrochloric Acid SCHEMBL913465 0.94 DGAT2 (0.35) LPAR1KDM4EATMMAPTMAPK1
Hydrochloric Acid SCHEMBL544286 0.93 LPAR1 (0.39) LPAR1KDM4EATMMAPTMAPK1
Hydrochloric Acid SCHEMBL545153 0.92 PAICS (0.35) LPAR1KDM4EATMMAPTMAPK1
Hydrochloric Acid SCHEMBL544176 0.92 PAICS (0.37) KDM4EATMMAPTMAPK1PAICS
SCHEMBL2486261 0.92 KDM4E (0.36) KDM4EATMMAPTMAPK1PAICS
SCHEMBL2486264 0.92 KDM4E (0.36) KDM4EATMMAPTMAPK1PAICS
SCHEMBL2486263 0.92 KDM4E (0.36) KDM4EATMMAPTMAPK1PAICS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2059508-B1 5,6-BISARYL-2-PYRIDINE-CARBOXAMIDE DERIVATIVES, PREPARATION AND APPLICATION THEREOF IN THERAPEUTICS AS UROTENSIN II RECEPTOR ANTAGONISTS SANOFI SA (FR) 2012-04-11 EP claimed
EP-2238110-B1 5.6-BISARYL-2-PYRIDINE-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF AS ANTAGONISTS FOR UROTENSINE II RECEPTORS SANOFI SA (FR) 2011-10-26 EP claimed
EP-2238110-A1 5.6-BISARYL-2-PYRIDINE-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF AS ANTAGONISTS FOR UROTENSINE II RECEPTORS Sanofi-Aventis (FR) 2010-10-13 EP claimed
WO-2009115665-A1 5.6-BISARYL-2-PYRIDINE-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF AS ANTAGONISTS FOR UROTENSINE II RECEPTORS SANOFI-AVENTIS (FR) 2009-09-24 WO claimed
EP-2238110-B1 5.6-BISARYL-2-PYRIDINE-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF AS ANTAGONISTS FOR UROTENSINE II RECEPTORS SANOFI SA (FR) 2011-10-26 EP disclosed
EP-2238110-A1 5.6-BISARYL-2-PYRIDINE-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF AS ANTAGONISTS FOR UROTENSINE II RECEPTORS Sanofi-Aventis (FR) 2010-10-13 EP disclosed
WO-2009115665-A1 5.6-BISARYL-2-PYRIDINE-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF AS ANTAGONISTS FOR UROTENSINE II RECEPTORS SANOFI-AVENTIS (FR) 2009-09-24 WO disclosed