SCHEMBL30795677

SCHEMBL30795677

CN(C)c1nc2cccc(F)c2c(=O)n1NC(=O)Cc1cc(F)cc(C(F)(F)F)c1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.37
GLS O94925 1/20 0.36
KDM4E B2RXH2 2/20 0.36
CSNK1D P48730 1/20 0.35
PTGES O14684 1/20 0.34
ALDH1A1 P00352 2/20 0.34
TRPV1 Q8NER1 2/20 0.34
RXFP1 Q9HBX9 1/20 0.34
GPR52 Q9Y2T5 2/20 0.34
P2RX7 Q99572 1/20 0.34
TACR1 P25103 2/20 0.33
SCD O00767 1/20 0.33
GAA P10253 1/20 0.33
ROCK2 O75116 1/20 0.33
UBE2M P61081 1/20 0.33
DCUN1D1 Q96GG9 1/20 0.33

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
SCHEMBL2751798 1.00 RORC (0.37) RORCGLSKDM4ECSNK1DPTGES
SCHEMBL2750643 0.92 ALDH1A1 (0.38) ALDH1A1TRPV1RXFP1
SCHEMBL30795721 0.92 ALDH1A1 (0.38) ALDH1A1TRPV1RXFP1
SCHEMBL30795508 0.83 ALDH1A1 (0.36) GLSALDH1A1TRPV1RXFP1
SCHEMBL2751707 0.83 ALDH1A1 (0.36) GLSALDH1A1TRPV1RXFP1
SCHEMBL30796811 0.83 GPR139 (0.36) ALDH1A1TRPV1RXFP1
SCHEMBL2751807 0.83 GPR139 (0.36) ALDH1A1TRPV1RXFP1
SCHEMBL30794424 0.82 ALDH1A1 (0.38) KDM4EALDH1A1TRPV1RXFP1
SCHEMBL2750839 0.82 ALDH1A1 (0.38) KDM4EALDH1A1TRPV1RXFP1
SCHEMBL30796323 0.78 RAB9A (0.50) ALDH1A1RXFP1GAA

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