SCHEMBL30795231

SCHEMBL30795231

Cc1c(C(=O)NCc2cccc(F)c2)c(=O)n(C)c2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.61
MEN1 O00255 4/20 0.61
NPC1 O15118 2/20 0.60
RAB9A P51151 1/20 0.60
TSHR P16473 1/20 0.53
EGFR P00533 1/20 0.52
SRC P12931 1/20 0.52
ROCK2 O75116 1/20 0.49
TP53 P04637 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
ALDH1A1 P00352 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
CASP3 P42574 1/20 0.48
KDM4E B2RXH2 1/20 0.48
PDE10A Q9Y233 1/20 0.46

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
SCHEMBL713993 1.00 KMT2A (0.61) KMT2AMEN1NPC1RAB9ATSHR
SCHEMBL28622 0.92 KMT2A (0.54) KMT2AMEN1NPC1RAB9ATSHR
SCHEMBL30795447 0.92 KMT2A (0.54) KMT2AMEN1NPC1RAB9ATSHR
SCHEMBL29874 0.89 EGLN1 (0.51) KMT2AMEN1NPC1RAB9ATSHR
SCHEMBL30794538 0.89 EGLN1 (0.51) KMT2AMEN1NPC1RAB9ATSHR
SCHEMBL30795142 0.89 MEN1 (0.51) KMT2AMEN1NPC1RAB9AROCK2
SCHEMBL30794517 0.89 EGLN1 (0.51) KMT2AMEN1NPC1RAB9ATSHR
SCHEMBL29744 0.89 MEN1 (0.51) KMT2AMEN1NPC1RAB9AROCK2
SCHEMBL715292 0.87 ROCK2 (0.48) KMT2AMEN1NPC1RAB9ATSHR
SCHEMBL30795780 0.87 ROCK2 (0.48) KMT2AMEN1NPC1RAB9ATSHR

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