SCHEMBL30795705

SCHEMBL30795705

O=C(Cc1ccc(Cl)cc1)Nn1nc(-c2ccccc2)c2ccccc2c1=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.59
NPSR1 Q6W5P4 3/20 0.59
LMNA P02545 2/20 0.59
CYP1A2 P05177 1/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2D6 P10635 1/20 0.59
CYP2C9 P11712 1/20 0.59
CYP2C19 P33261 1/20 0.59
HTT P42858 1/20 0.59
KDM4E B2RXH2 1/20 0.50
HPGD P15428 1/20 0.50
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
GAA P10253 1/20 0.49
ALOX15 P16050 1/20 0.48
PARP1 P09874 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
CACNA1G O43497 1/20 0.46
CACNA1H O95180 1/20 0.46
CACNA1I Q9P0X4 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
SCHEMBL1788479 1.00 ALDH1A1 (0.59) ALDH1A1NPSR1LMNACYP1A2CYP3A4
SCHEMBL30796290 0.96 ALDH1A1 (0.54) ALDH1A1NPSR1LMNACYP1A2CYP3A4
SCHEMBL1790529 0.96 ALDH1A1 (0.54) ALDH1A1NPSR1LMNACYP1A2CYP3A4
SCHEMBL30796074 0.95 ALDH1A1 (0.53) ALDH1A1NPSR1LMNACYP1A2CYP3A4
SCHEMBL1789674 0.95 ALDH1A1 (0.53) ALDH1A1NPSR1LMNACYP1A2CYP3A4
SCHEMBL30795597 0.92 LMNA (0.50) ALDH1A1NPSR1LMNACYP1A2CYP3A4
SCHEMBL1786960 0.92 LMNA (0.50) ALDH1A1NPSR1LMNACYP1A2CYP3A4
SCHEMBL1787437 0.91 ALDH1A1 (0.49) ALDH1A1NPSR1LMNACYP1A2CYP3A4
SCHEMBL1787827 0.91 ALDH1A1 (0.54) ALDH1A1NPSR1LMNACYP1A2CYP3A4
SCHEMBL1787368 0.91 ALDH1A1 (0.54) ALDH1A1NPSR1LMNACYP1A2CYP3A4

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