SCHEMBL30795566

SCHEMBL30795566

Cc1nn(NC(=O)Cc2cc(F)cc(F)c2)c(=O)c2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.48
▸ RAB9A P51151 1/20 0.46
▸ USP2 O75604 2/20 0.45
▸ SMN1; SMN2 Q16637 4/20 0.44
▸ MAPK1 P28482 1/20 0.43
▸ AKR1B1 P15121 1/20 0.43
▸ LMNA P02545 2/20 0.42
▸ HTT P42858 4/20 0.42
▸ TSHR P16473 3/20 0.42
▸ POLB P06746 2/20 0.42
▸ NR2F2 P24468 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL1786512 1.00 KMT2A (0.48) KMT2ARAB9AUSP2SMN1; SMN2MAPK1
SCHEMBL1789011 0.86 TRPV1 (0.41) KMT2AUSP2SMN1; SMN2AKR1B1LMNA
SCHEMBL30796852 0.86 TRPV1 (0.41) KMT2AUSP2SMN1; SMN2AKR1B1LMNA
SCHEMBL30814194 0.85 NLRP3 (0.41) USP2SMN1; SMN2AKR1B1LMNAHTT
SCHEMBL1791204 0.85 NLRP3 (0.41) USP2SMN1; SMN2AKR1B1LMNAHTT
SCHEMBL30795119 0.85 RAB9A (0.50) KMT2ARAB9ASMN1; SMN2POLBALDH1A1
SCHEMBL1789436 0.85 RAB9A (0.50) KMT2ARAB9ASMN1; SMN2POLBALDH1A1
SCHEMBL30796353 0.84 MAPT (0.50) KMT2ARAB9AUSP2SMN1; SMN2AKR1B1
SCHEMBL30796507 0.84 TRPV1 (0.42) KMT2AUSP2SMN1; SMN2AKR1B1LMNA
SCHEMBL1790031 0.84 TRPV1 (0.42) KMT2AUSP2SMN1; SMN2AKR1B1LMNA

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 4 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-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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