SCHEMBL8124149

SCHEMBL8124149

CN(Cc1cccc(-c2cnc(-c3ccc(F)cc3)[nH]2)c1)C(c1ccccc1)C1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 2/20 0.40
CNR2 P34972 8/20 0.39
CNR1 P21554 3/20 0.39
SCN2A Q99250 3/20 0.39
BACE1 P56817 2/20 0.37
BACE2 Q9Y5Z0 1/20 0.37
SPHK1 Q9NYA1 1/20 0.37
NPY5R Q15761 1/20 0.36

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
SCHEMBL7140243 0.95 SCN2A (0.42) HPGDSCNR2CNR1SCN2ASPHK1
SCHEMBL8108537 0.85 SPHK1 (0.42) HPGDSCNR2CNR1SCN2ASPHK1
SCHEMBL7135182 0.80 SCN2A (0.41) HPGDSCNR2CNR1SCN2ASPHK1
SCHEMBL8124147 0.80 HPGDS (0.41) HPGDSCNR2CNR1SCN2ABACE1
SCHEMBL7145620 0.79 SCN2A (0.41) HPGDSCNR2CNR1SCN2ASPHK1
SCHEMBL7143632 0.79 SPHK1 (0.43) CNR2CNR1SCN2ASPHK1NPY5R
SCHEMBL8190596 0.76 CNR2 (0.46) HPGDSCNR2CNR1SCN2ABACE1
SCHEMBL8119014 0.75 KCNH2 (0.51) HPGDSCNR2CNR1BACE1SPHK1
SCHEMBL8108540 0.73 SPHK1 (0.39) HPGDSCNR2CNR1BACE1SPHK1
SCHEMBL7140240 0.72 SCN2A (0.42) HPGDSCNR2CNR1SCN2ASPHK1

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-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-6121260-A Method of treating conditions susceptible to modulation of NPY receptors with diarylimidazole derivatives NEUROGEN CORPORATION (US) 2000-09-19 US disclosed