SCHEMBL30794584

SCHEMBL30794584

C[C@@H]1CC[C@H](c2noc(-c3ccc(F)cc3)n2)CN1C(=O)c1cccc(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.46
HCRTR1 O43613 11/20 0.46
HCRTR2 O43614 11/20 0.46
HSD11B1 P28845 3/20 0.44
IDO1 P14902 1/20 0.43
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL599401 1.00 GRM5 (0.46) GRM5HCRTR1HCRTR2HSD11B1IDO1
SCHEMBL599430 0.88 HCRTR1 (0.49) GRM5HCRTR1HCRTR2IDO1
SCHEMBL601360 0.88 HCRTR1 (0.49) GRM5HCRTR1HCRTR2IDO1
SCHEMBL7879633 0.86 HCRTR2 (0.43) GRM5HCRTR1HCRTR2HSD11B1NPC1
SCHEMBL7878360 0.83 HCRTR2 (0.42) GRM5HCRTR1HCRTR2HSD11B1NPC1
SCHEMBL601120 0.82 HCRTR1 (0.45) HCRTR1HCRTR2IDO1
SCHEMBL30795715 0.82 HCRTR1 (0.45) HCRTR1HCRTR2IDO1
SCHEMBL599266 0.82 IDO1 (0.50) GRM5HCRTR1HCRTR2HSD11B1IDO1
SCHEMBL599268 0.82 IDO1 (0.50) GRM5HCRTR1HCRTR2HSD11B1IDO1
SCHEMBL599267 0.82 IDO1 (0.50) GRM5HCRTR1HCRTR2HSD11B1IDO1

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