SCHEMBL30795646

SCHEMBL30795646

N#Cc1cc(Br)cc(-n2ccc(-c3ccccn3)n2)c1

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 10/20 0.71
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
CRHR1 P34998 3/20 0.44

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
SCHEMBL3920978 1.00 GRM5 (0.71) GRM5KDM4EALDH1A1MAPTTSHR
SCHEMBL3929713 0.87 GRM5 (0.57) GRM5KDM4EALDH1A1HTTCRHR1
SCHEMBL30795341 0.87 GRM5 (0.57) GRM5KDM4EALDH1A1HTTCRHR1
SCHEMBL14380696 0.85 GRM5 (0.71) GRM5KDM4EALDH1A1MAPTTSHR
SCHEMBL3928571 0.85 GRM5 (0.71) GRM5
SCHEMBL5217184 0.85 GRM5 (0.71) GRM5KDM4EALDH1A1MAPTTSHR
SCHEMBL3922587 0.83 GRM5 (1.00) GRM5KDM4EALDH1A1MAPTTSHR
SCHEMBL3924739 0.82 GRM5 (0.67) GRM5KDM4EALDH1A1MAPTTSHR
SCHEMBL3931406 0.81 GRM5 (0.51) GRM5KDM4E
SCHEMBL3928998 0.78 GRM5 (0.68) GRM5KDM4EALDH1A1MAPTTSHR

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-4584250-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS Biohaven Therapeutics Ltd. (VG) 2025-07-16 EP disclosed
WO-2024054811-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-14 WO disclosed