SCHEMBL30795339

SCHEMBL30795339

Cc1cc(N2CCc3ncccc3C2)nc(N2CCC(F)(F)CC2)c1NC(=O)CC1CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNQ2 O43526 2/20 0.40
HDAC6 Q9UBN7 1/20 0.39
KIF18A Q8NI77 2/20 0.36
PTGER4 P35408 1/20 0.35
JAK2 O60674 1/20 0.35
SRC P12931 1/20 0.35
GRIN2D O15399 3/20 0.34
GRIN3B O60391 3/20 0.34
GRIN1 Q05586 3/20 0.34
GRIN2A Q12879 3/20 0.34
GRIN2B Q13224 3/20 0.34
GRIN2C Q14957 3/20 0.34
GRIN3A Q8TCU5 3/20 0.34
P2RX7 Q99572 1/20 0.34
PDE10A Q9Y233 1/20 0.34
IDH1 O75874 2/20 0.34
DRD2 P14416 2/20 0.34
DRD3 P35462 2/20 0.34
CHRM1 P11229 1/20 0.34
ADRA1D P25100 1/20 0.34

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
SCHEMBL2679556 1.00 KCNQ2 (0.40) KCNQ2HDAC6KIF18APTGER4JAK2
SCHEMBL30794388 0.86 HDAC6 (0.40) KCNQ2HDAC6PTGER4GRIN2DGRIN3B
SCHEMBL2680190 0.86 HDAC6 (0.40) KCNQ2HDAC6PTGER4GRIN2DGRIN3B
SCHEMBL30795362 0.86 GRIN2D (0.47) KCNQ2HDAC6KIF18APTGER4GRIN2D
SCHEMBL2680336 0.86 GRIN2D (0.47) KCNQ2HDAC6KIF18APTGER4GRIN2D
SCHEMBL2680089 0.85 PTGER4 (0.46) KCNQ2HDAC6KIF18APTGER4GRIN2D
SCHEMBL30795847 0.85 PTGER4 (0.46) KCNQ2HDAC6KIF18APTGER4GRIN2D
SCHEMBL2680162 0.82 HDAC6 (0.40) KCNQ2HDAC6KIF18APTGER4GRIN2D
SCHEMBL2679534 0.82 GRM1 (0.51) KCNQ2HDAC6KIF18APTGER4GRIN2D
SCHEMBL30794452 0.82 GRM1 (0.51) KCNQ2HDAC6KIF18APTGER4GRIN2D

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 5 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
EP-4580679-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND NMDA RECEPTOR ANTAGONISTS Biohaven Therapeutics Ltd. (VG) 2025-07-09 EP disclosed
WO-2024054811-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-14 WO disclosed
WO-2024054807-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND TDP-43 MODULATORS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-14 WO disclosed
WO-2024050389-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND NMDA RECEPTOR ANTAGONISTS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-07 WO disclosed