SCHEMBL30795700

SCHEMBL30795700

O=C(Cc1cccc(C(F)(F)F)c1)Nn1nc(-c2ccc(Cl)cc2)c2ccccc2c1=O

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.61
▸ TP53 P04637 4/20 0.61
▸ KDM4E B2RXH2 1/20 0.52
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ POLB P06746 1/20 0.47
▸ LMNA P02545 3/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ CCR1 P32246 1/20 0.44
▸ KCNK3 O14649 1/20 0.44
▸ KCNK9 Q9NPC2 1/20 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
SCHEMBL1791101 1.00 MAPT (0.61) MAPTTP53KDM4EMEN1KMT2A
SCHEMBL1787351 0.89 TP53 (0.54) MAPTTP53KDM4EMEN1KMT2A
SCHEMBL30794862 0.89 TP53 (0.54) MAPTTP53KDM4EMEN1KMT2A
SCHEMBL30796105 0.88 MAPT (0.49) MAPTTP53MEN1KMT2ALMNA
SCHEMBL1791439 0.88 MAPT (0.49) MAPTTP53MEN1KMT2ALMNA
SCHEMBL30794501 0.86 TP53 (0.54) MAPTTP53KDM4EMEN1KMT2A
SCHEMBL1784447 0.86 TP53 (0.54) MAPTTP53KDM4EMEN1KMT2A
SCHEMBL30796074 0.86 ALDH1A1 (0.53) MAPTTP53MEN1KMT2APOLB
SCHEMBL1789674 0.86 ALDH1A1 (0.53) MAPTTP53MEN1KMT2APOLB
SCHEMBL1789483 0.85 TP53 (0.59) MAPTTP53MEN1KMT2APOLB

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
Send feedback