SCHEMBL7159259

SCHEMBL7159259

COc1cn(-c2cc(F)cc(Br)c2)cn1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
NLRP3 Q96P20 1/20 0.32
NR2E1 Q9Y466 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
SCHEMBL7172172 0.79 NR2E1 (0.48) NR2E1
SCHEMBL20259896 0.73 NPC1 (0.35) NPC1RAB9ANLRP3NR2E1
SCHEMBL4427744 0.73 PDE3B (0.40) NPC1RAB9ANLRP3
SCHEMBL19402311 0.70 IDH1 (0.31) NPC1RAB9ANLRP3
SCHEMBL6057543 0.68 NPC1 (0.41) NPC1RAB9ANLRP3
SCHEMBL5222724 0.66 CYP11B1 (0.47)
SCHEMBL28711313 0.66 BUB1 (0.32)
Hydrochloric Acid SCHEMBL4423060 0.65 KCNH2 (0.42)
SCHEMBL5960041 0.65 CYP11B1 (0.46)
SCHEMBL7172434 0.65 KDM2B (0.48)

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-1358165-A1 IMIDAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-11-05 EP disclosed
WO-2002060877-A1 IMIDAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-08-08 WO disclosed