SCHEMBL6185945

SCHEMBL6185945

O=C(Nc1cc(-c2ccccc2)[nH]n1)Nc1cc(Cl)ccc1C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GRIK1 P39086 16/20 0.62
▸ NPC1 O15118 2/20 0.61
▸ RAB9A P51151 2/20 0.61
▸ MAPT P10636 1/20 0.61
▸ ALPL P05186 1/20 0.59
▸ ALPI P09923 1/20 0.59
▸ NPY5R Q15761 1/20 0.54

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
SCHEMBL5950123 0.80 GRIK1 (0.62) GRIK1
SCHEMBL3962633 0.77 GRIK1 (1.00) GRIK1NPC1RAB9A
SCHEMBL6566353 0.76 NPC1 (1.00) NPC1RAB9AMAPTALPLALPI
SCHEMBL3962638 0.76 GRIK1 (0.72) GRIK1
SCHEMBL3957387 0.76 GRIK1 (1.00) GRIK1
SCHEMBL3957527 0.76 GRIK1 (1.00) GRIK1
SCHEMBL3960265 0.74 GRIK1 (1.00) GRIK1NPC1RAB9A
SCHEMBL5950391 0.74 GRIK1 (0.72) GRIK1RAB9AMAPT
SCHEMBL3961542 0.73 GRIK1 (1.00) GRIK1
SCHEMBL6565951 0.73 ALPL (0.76) NPC1RAB9AMAPTALPLALPI

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-1537075-A2 DIARYLUREA DERIVATIVES AND THEIR USE AS CHLORIDE CHANNEL BLOCKERS NEUROSEARCH A/S (DK) 2005-06-08 — — EP disclosed
WO-2004022529-A2 DIARYLUREA DERIVATIVES AND THEIR USE AS CHLORIDE CHANNEL BLOCKERS NEUROSEARCH A/S (DK) 2004-03-18 — — WO disclosed
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