SCHEMBL2315535

SCHEMBL2315535

Cn1ncc(OC(=O)NC23CC4CC(CC(C4)C2)C3)c1-c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
CNR2 P34972 6/20 0.46
CNR1 P21554 5/20 0.45
FAAH O00519 3/20 0.43
EPHX2 P34913 3/20 0.42
PIN1 Q13526 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL2323579 0.84 CNR1 (0.47) CNR2CNR1EPHX2
SCHEMBL2316495 0.81 POLB (0.55) POLBCNR2CNR1FAAHHPGD
SCHEMBL2318742 0.75 ALDH1A1 (0.53) CNR1FAAH
SCHEMBL1420777 0.73 FAAH (0.61) CNR2FAAHEPHX2MEN1KMT2A
SCHEMBL2318297 0.73 HTT (0.35) CNR2CNR1FAAHEPHX2
SCHEMBL2320470 0.72 TDP1 (0.52) EPHX2
SCHEMBL2315297 0.72 MEN1 (0.48) CNR2CNR1EPHX2MEN1KMT2A
SCHEMBL16908728 0.72 POLB (0.43) POLBEPHX2
SCHEMBL14263139 0.71 CNR2 (0.50) POLBCNR2CNR1PIN1
SCHEMBL2316419 0.69 P2RX7 (0.57) CNR2CNR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1928840-B1 1H-Pyrazole-4-carboxamides, their preparation and their use as 11-beta-hydroxysteroid dehydrogenase inhibitors HOFFMANN LA ROCHE (CH) 2011-08-10 EP claimed