SCHEMBL3968068

SCHEMBL3968068

N#Cc1ccc(COc2ccc(C3(C(=O)c4nccc5c4C(=O)OC54CCNC4)CC3)cc2)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSC P53634 3/20 0.35
P2RX7 Q99572 1/20 0.34
KCNH2 Q12809 3/20 0.34
RORC P51449 1/20 0.32
GLP1R P43220 3/20 0.32
SCN9A Q15858 1/20 0.31
FFAR4 Q5NUL3 2/20 0.30
GPR119 Q8TDV5 1/20 0.30
CTSB P07858 1/20 0.30

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
SCHEMBL3975332 0.88 MAOB (0.36) KCNH2FFAR4
SCHEMBL3969701 0.84 RORC (0.36) KCNH2RORC
SCHEMBL3972419 0.83 NR4A2 (0.39) KCNH2
SCHEMBL350865 0.82 ADAM17 (0.36) RORC
SCHEMBL3973984 0.81 HTT (0.33)
SCHEMBL3907137 0.79 PDE2A (0.32)
SCHEMBL3971304 0.78 ALOX5AP (0.42)
SCHEMBL3970810 0.77 AKT1 (0.32)
SCHEMBL2973860 0.76 HSD11B1 (0.31)
SCHEMBL3977568 0.74 HSD11B1 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1756063-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2009-03-25 EP claimed
EP-1756063-A1 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-02-28 EP claimed
WO-2005110992-A1 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2005-11-24 WO claimed