SCHEMBL5200340

SCHEMBL5200340

COC(OC)C(N)Cc1cc(Cl)cc2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 2/20 0.34
F2 P00734 1/20 0.33
PTGS2 P35354 1/20 0.32
SCN4A P35499 2/20 0.31
AOC3 Q16853 1/20 0.31
PNMT P11086 1/20 0.31
HTR2A P28223 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HIF1A Q16665 1/20 0.31
HSD17B10 Q99714 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL2769421 0.71 HTR2A (0.50) PTGS2PNMTHTR2AHIF1AHSD17B10
SCHEMBL28948705 0.71 PTGS2 (0.42) PTGS2HTR2ACYP1A2CYP2D6CYP2C9
SCHEMBL19399649 0.71 IDO1 (0.47) CYP1A2CYP2C9CYP2C19
SCHEMBL23391560 0.71 IDO1 (0.47) CYP1A2CYP2C9CYP2C19
SCHEMBL2769756 0.70 MEN1 (0.40) PTGS2CYP1A2CYP2D6CYP2C19MEN1
SCHEMBL5200343 0.69 HTR2A (0.34) F2PTGS2HTR2ACYP1A2CYP2D6
SCHEMBL4153146 0.68 TAAR1 (0.47) HTR2ACYP1A2CYP2D6L3MBTL1HTR2C
SCHEMBL13576841 0.68 ACLY (0.47) CYP1A2CYP2C19L3MBTL1MEN1KMT2A
SCHEMBL15352016 0.68 L3MBTL1 (0.41) PTGS2HTR2ACYP1A2CYP2C9CYP2C19
SCHEMBL4339469 0.68 L3MBTL1 (0.41) PTGS2HTR2ACYP1A2CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1753739-A1 IMIDAZOL-2-ONE COMPOUNDS USEFUL IN THE TREATMENT OF VARIOUS DISORDERS GLAXO GROUP LIMITED (GB) 2007-02-21 EP disclosed
WO-2005121122-A1 IMIDAZOL-2-ONE COMPOUNDS USEFUL IN THE TREATMENT OF VARIOUS DISORDERS GLAXO GROUP LIMITED (GB) 2005-12-22 WO disclosed