SCHEMBL2336422

SCHEMBL2336422

Cn1c(=O)n(C(=O)NCC2CCN(CC(COc3ccc(F)cc3)OC(N)=O)CC2)c2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 3/20 0.41
TSHR P16473 1/20 0.38
CYP2D6 P10635 1/20 0.36
FAAH O00519 1/20 0.36
ACHE P22303 1/20 0.36
CNR2 P34972 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL15103575 0.94 HTR4 (0.43) HTR4FAAHACHE
SCHEMBL2337032 0.93 ACHE (0.43) HTR4CYP2D6FAAHACHEKMT2A
Hydrochloric Acid SCHEMBL2337272 0.93 HTR4 (0.43) HTR4FAAHACHE
SCHEMBL2333495 0.92 FAAH (0.43) HTR4TSHRCYP2D6FAAHACHE
SCHEMBL2335214 0.91 HTR4 (0.40) HTR4FAAHACHEMEN1KMT2A
SCHEMBL2332265 0.91 HTR4 (0.53) HTR4
SCHEMBL2331954 0.88 TSHR (0.52) TSHRCYP2D6MEN1KMT2A
Hydrochloric Acid SCHEMBL3304278 0.87 TSHR (0.52) TSHRCYP2D6
SCHEMBL3301369 0.85 HTR4 (0.42) HTR4TSHRCYP2D6FAAHACHE
SCHEMBL15103540 0.84 HTR4 (0.56) HTR4

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-2358702-B1 PIPERIDINE COMPOUNDS, PHARMACEUTICAL COMPOSITION COMPRISING THE SAME AND ITS USE SK BIOPHARMACEUTICALS CO LTD (KR) 2013-07-17 EP disclosed
EP-2358702-A2 PIPERIDINE COMPOUNDS, PHARMACEUTICAL COMPOSITION COMPRISING THE SAME AND ITS USE SK Holdings Co., Ltd. (KR) 2011-08-24 EP disclosed
WO-2010044585-A2 PIPERIDINE COMPOUNDS, PHARMACEUTICAL COMPOSITION COMPRISING THE SAME AND ITS USE SK HOLDINGS CO., LTD. (KR) 2010-04-22 WO disclosed