SCHEMBL30814174

SCHEMBL30814174

O=C(Cc1ccccc1)Nn1nc(C(F)(F)F)c2ccccc2c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.43
▸ POLB P06746 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ NPSR1 Q6W5P4 2/20 0.42
▸ MAPT P10636 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ AKR1B1 P15121 2/20 0.41
▸ HTT P42858 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ ALOX12 P18054 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41
▸ CNR2 P34972 2/20 0.40
▸ ELOVL1 Q9BW60 1/20 0.40
▸ CACNA1G O43497 1/20 0.40
▸ CACNA1I Q9P0X4 1/20 0.40

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
SCHEMBL1789193 1.00 MEN1 (0.45) MEN1KMT2AL3MBTL1KDM4EPOLB
SCHEMBL30795856 0.93 LMNA (0.52) KDM4EPOLBLMNAAKR1B1CNR2
SCHEMBL1786577 0.93 LMNA (0.52) KDM4EPOLBLMNAAKR1B1CNR2
SCHEMBL30795173 0.92 KDM4E (0.49) MEN1KMT2AKDM4EPOLBLMNA
SCHEMBL1788526 0.92 KDM4E (0.49) MEN1KMT2AKDM4EPOLBLMNA
SCHEMBL30796507 0.89 TRPV1 (0.42) MEN1KMT2AKDM4EPOLBLMNA
SCHEMBL1790031 0.89 TRPV1 (0.42) MEN1KMT2AKDM4EPOLBLMNA
SCHEMBL1789625 0.89 CACNA1H (0.48) KMT2APOLBLMNAALDH1A1CNR2
SCHEMBL30796164 0.89 CACNA1H (0.48) KMT2APOLBLMNAALDH1A1CNR2
SCHEMBL30796432 0.89 PTGS2 (0.43) MEN1KMT2AKDM4EPOLBLMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4580679-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND NMDA RECEPTOR ANTAGONISTS Biohaven Therapeutics Ltd. (VG) 2025-07-09 — — EP 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
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