SCHEMBL4657609

SCHEMBL4657609

O=C(O)c1cc2ccccc2n1Cc1cccc(C(F)(F)F)c1

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 6/20 0.71
PPARG P37231 12/20 0.70
CCR9 P51686 1/20 0.58
PLA2G10 O15496 1/20 0.58

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
SCHEMBL3722974 0.89 PPARG (0.68) CCR2PPARGPLA2G10
SCHEMBL30425654 0.89 PPARG (0.68) CCR2PPARGPLA2G10
SCHEMBL4208025 0.87 CCR2 (0.74) CCR2PPARGCCR9
SCHEMBL3198946 0.87 CCR2 (0.71) CCR2PPARGCCR9
SCHEMBL6599972 0.87 PPARG (0.68) CCR2PPARGCCR9
SCHEMBL3664981 0.87 CCR2 (0.63) CCR2PPARGCCR9
SCHEMBL6300893 0.87 CCR2 (0.63) CCR2PPARGCCR9
SCHEMBL3571653 0.84 NOD2 (0.67) PPARG
SCHEMBL940444 0.84 CCR9 (0.61) CCR2PPARGCCR9
SCHEMBL940279 0.84 CCR2 (0.59) CCR2PPARGCCR9

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-1776340-B1 N-(1H-INDOLYL)-H-INDOLE-2-CARB0XAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC USE SANOFI AVENTIS (FR) 2008-12-03 EP disclosed
EP-1776340-A1 N-(1H-INDOLYL)-H-INDOLE-2-CARB0XAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC USE Sanofi-Aventis (FR) 2007-04-25 EP disclosed
WO-2006024776-A1 N(1 H-INDOLYL)-1 H-INDOLE-2-CARB0XAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC USE SANOFI-AVENTIS (FR) 2006-03-09 WO disclosed
EP-1150952-B1 INDOLE DERIVATIVES AND THEIR USE AS MCP-1 RECEPTOR ANTAGONISTS ASTRAZENECA AB (SE) 2004-10-27 EP disclosed
EP-1341761-A1 SUBSTITUTED INDOLES, PHARMACEUTICAL COMPOSITIONS CONTAINING SUCH INDOLES AND THEIR USE AS PPAR-$g(g) BINDING AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2003-09-10 EP disclosed
EP-1003504-B1 INDOLE DERIVATIVES AND THEIR USE AS MCP-1 ANTAGONISTS ASTRAZENECA AB (SE) 2003-07-02 EP disclosed
WO-2002030895-A1 SUBSTITUTED INDOLES, PHARMACEUTICAL COMPOSITIONS CONTAINING SUCH INDOLES AND THEIR USE AS PPAR-η BINDING AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2002-04-18 WO disclosed