SCHEMBL4083764

SCHEMBL4083764

O=C(O)N1CCN(c2ccc(C3(C(=O)N4CCC(c5cccnc5)C4)CC3)c(F)c2)CC1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 12/20 0.55
SPR P35270 1/20 0.44
NAMPT P43490 1/20 0.43
RORC P51449 4/20 0.43
MMP2 P08253 1/20 0.38
MMP13 P45452 1/20 0.38
ADAMTS5 Q9UNA0 1/20 0.38
HDAC4 P56524 1/20 0.37

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
SCHEMBL349688 0.90 HSD11B1 (0.51) HSD11B1SPRNAMPTRORCHDAC4
SCHEMBL351480 0.78 HSD11B1 (0.65) HSD11B1SPR
SCHEMBL350846 0.73 HSD11B1 (0.59) HSD11B1
SCHEMBL350847 0.73 HSD11B1 (0.59) HSD11B1
SCHEMBL350421 0.73 HSD11B1 (0.59) HSD11B1
SCHEMBL350420 0.73 HSD11B1 (0.59) HSD11B1
SCHEMBL5901385 0.73 HSD11B1 (0.57) HSD11B1SPRNAMPTADAMTS5
SCHEMBL350061 0.72 HSD11B1 (0.82) HSD11B1SPR
SCHEMBL350402 0.71 HSD11B1 (1.00) HSD11B1SPR
SCHEMBL4965635 0.71 SMN1; SMN2 (0.46) RORCMMP13ADAMTS5

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
EP-2963021-A1 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Holdings Corporation (US) 2016-01-06 EP claimed
EP-2963021-A1 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Holdings Corporation (US) 2016-01-06 EP disclosed
EP-1756063-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2009-03-25 EP disclosed
EP-1756063-A1 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-02-28 EP disclosed
WO-2005110992-A1 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2005-11-24 WO disclosed