SCHEMBL30794837

SCHEMBL30794837

CC1(CC(=O)Nn2nc(-c3ccc(Cl)cc3)c3ccccc3c2=O)CCCC1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.53
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
TP53 P04637 5/20 0.48
RXFP1 Q9HBX9 3/20 0.48
THRB P10828 1/20 0.48
MAPT P10636 5/20 0.48
POLB P06746 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
ALDH1A1 P00352 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
NPC1 O15118 1/20 0.45

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
SCHEMBL1785812 1.00 LMNA (0.53) LMNAMEN1KMT2ATP53RXFP1
SCHEMBL1789626 0.86 LMNA (0.49) LMNAMEN1KMT2ATP53RXFP1
SCHEMBL30795459 0.86 LMNA (0.49) LMNAMEN1KMT2ATP53RXFP1
SCHEMBL30795520 0.85 TP53 (0.49) LMNAMEN1KMT2ATP53RXFP1
SCHEMBL1788796 0.85 TP53 (0.49) LMNAMEN1KMT2ATP53RXFP1
SCHEMBL30795029 0.81 P2RX7 (0.49) LMNAMEN1KMT2ATP53RXFP1
SCHEMBL1785767 0.81 P2RX7 (0.49) LMNAMEN1KMT2ATP53RXFP1
SCHEMBL30795414 0.80 MAPT (0.54) LMNAMEN1KMT2ATP53RXFP1
SCHEMBL1785578 0.80 MAPT (0.54) LMNAMEN1KMT2ATP53RXFP1
SCHEMBL1790529 0.79 ALDH1A1 (0.54) LMNAMEN1KMT2ATP53RXFP1

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