SCHEMBL7143474

SCHEMBL7143474

N#Cc1cccc(-c2c[nH]c(-c3ccc(F)cc3)n2)c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 4/20 0.53
GABRB3 P28472 4/20 0.53
GABRA5 P31644 4/20 0.53
GABRA3 P34903 4/20 0.53
IDO1 P14902 2/20 0.47
NPY5R Q15761 1/20 0.46
XDH P47989 1/20 0.45
HDAC2 Q92769 1/20 0.43
CLK4 Q9HAZ1 1/20 0.42
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41
MAOB P27338 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CDC7 O00311 1/20 0.40
ALDH1A3 P47895 1/20 0.40

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
SCHEMBL8118629 0.94 GABRG2 (0.51) GABRG2GABRB3GABRA5GABRA3IDO1
SCHEMBL7141999 0.88 IDO1 (0.51) GABRG2GABRB3GABRA5GABRA3IDO1
SCHEMBL27544569 0.84 GABRG2 (0.51) GABRG2GABRB3GABRA5GABRA3IDO1
SCHEMBL7810052 0.82 IDO1 (0.46) GABRG2GABRB3GABRA5GABRA3IDO1
SCHEMBL4971912 0.80 GABRG2 (0.41) GABRG2GABRB3GABRA5GABRA3NPY5R
SCHEMBL7809837 0.79 PTGDR (0.48) IDO1CLK4MEN1KMT2A
SCHEMBL7141855 0.79 KDM4E (0.45) NPY5RMEN1KMT2AALDH1A3
SCHEMBL26110507 0.79 KDM4E (0.45) NPY5RMEN1KMT2AALDH1A3
SCHEMBL26463821 0.78 KDM4E (0.44) NPY5RCLK4MEN1KMT2ACDC7
SCHEMBL15029205 0.78 MAPK1 (0.42) CLK4MEN1KMT2ACDC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6515133-B1 Certain diaryl imidazoles act as partial agonists or antagonists for NPY receptors, in particular NPY 5 receptors. They are of use, for example in treating loss of appetite. Such compounds bear aryl groups in the 2 position. NEUROGEN CORPORATION 2003-02-04 US claimed
CN-1265033-A Certain diarylimidaozle derivatives, new class of NPY speific ligands NEUROGEN CORP (US) 2000-08-30 CN claimed
EP-0996443-A1 CERTAIN DIARYLIMIDAZOLE DERIVATIVES; A NEW CLASS OF NPY SPECIFIC LIGANDS NEUROGEN CORPORATION (US) 2000-05-03 EP claimed
WO-1999001128-A1 CERTAIN DIARYLIMIDAZOLE DERIVATIVES; A NEW CLASS OF NPY SPECIFIC LIGANDS NEUROGEN CORPORATION (US) 1999-01-14 WO claimed
US-6515133-B1 Certain diaryl imidazoles act as partial agonists or antagonists for NPY receptors, in particular NPY 5 receptors. They are of use, for example in treating loss of appetite. Such compounds bear aryl groups in the 2 position. NEUROGEN CORPORATION 2003-02-04 US disclosed
US-6121260-A Method of treating conditions susceptible to modulation of NPY receptors with diarylimidazole derivatives NEUROGEN CORPORATION (US) 2000-09-19 US disclosed
CN-1265033-A Certain diarylimidaozle derivatives, new class of NPY speific ligands NEUROGEN CORP (US) 2000-08-30 CN disclosed