SCHEMBL4010671

SCHEMBL4010671

CN(C(=O)C1CC1)c1ccc(N2CCCC(NC(=O)C34CC5CC(C3)C(O)C(C5)C4)C2)cc1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.36
FASN P49327 5/20 0.35
EPHX1 P07099 2/20 0.35
CNR1 P21554 1/20 0.34
BTK Q06187 2/20 0.34
DRD2 P14416 1/20 0.34
DRD3 P35462 1/20 0.34
HSD11B1 P28845 3/20 0.33
EPHX2 P34913 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL4010665 1.00 F10 (0.36) F10FASNEPHX1CNR1BTK
SCHEMBL5951056 0.91 EPHX1 (0.38) EPHX1CNR1BTKDRD2DRD3
SCHEMBL4005578 0.91 EPHX1 (0.38) EPHX1CNR1BTKDRD2DRD3
SCHEMBL4138527 0.91 CNR1 (0.37) EPHX1CNR1BTKDRD2DRD3
SCHEMBL5950362 0.83 CNR1 (0.38) EPHX1CNR1DRD2DRD3HSD11B1
SCHEMBL4005560 0.83 CNR1 (0.38) EPHX1CNR1DRD2DRD3HSD11B1
SCHEMBL4148781 0.83 CNR1 (0.48) EPHX1CNR1DRD2DRD3HSD11B1
SCHEMBL4002885 0.83 CNR1 (0.43) CNR1DRD2DRD3EPHX2KMT2A
SCHEMBL4153054 0.83 CNR1 (0.43) CNR1DRD2DRD3EPHX2KMT2A
SCHEMBL5950713 0.82 ALDH1A1 (0.46) EPHX1CNR1KMT2A

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-1778229-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2009-06-17 EP claimed
EP-1778229-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-05-02 EP claimed
WO-2006020598-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-02-23 WO claimed