SCHEMBL26152155

SCHEMBL26152155

CC(C)(C)OC(=O)Nc1c(-c2ncccc2F)ccnc1C1CCC(F)(F)CC1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.38
ATR Q13535 1/20 0.36
HCRTR1 O43613 1/20 0.35
METAP1 P53582 1/20 0.35
ROCK2 O75116 1/20 0.34
ROCK1 Q13464 1/20 0.34
CDC42BPB Q9Y5S2 1/20 0.34
P2RX7 Q99572 5/20 0.33
SCN10A Q9Y5Y9 1/20 0.33
TSHR P16473 1/20 0.33
FSHR P23945 1/20 0.33
NAMPT P43490 1/20 0.33
MAPT P10636 2/20 0.33
GSK3B P49841 2/20 0.33
GPBAR1 Q8TDU6 1/20 0.33
LRRK2 Q5S007 1/20 0.32
TDP2 O95551 1/20 0.32
TGFBR1 P36897 1/20 0.32

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
SCHEMBL30418001 1.00 TRPV1 (0.38) TRPV1ATRHCRTR1METAP1ROCK2
SCHEMBL26151941 0.89 GSK3B (0.38) ATRHCRTR1SCN10ATSHRFSHR
SCHEMBL30445285 0.89 GSK3B (0.38) ATRHCRTR1SCN10ATSHRFSHR
SCHEMBL26152171 0.88 IDH1 (0.37) ATRSCN10ATSHRFSHRTGFBR1
SCHEMBL30419779 0.88 IDH1 (0.37) ATRSCN10ATSHRFSHRTGFBR1
SCHEMBL31058903 0.88 HCRTR1 (0.37) TRPV1ATRHCRTR1METAP1ROCK2
SCHEMBL30418921 0.88 HCRTR1 (0.37) TRPV1ATRHCRTR1METAP1ROCK2
SCHEMBL30417959 0.87 AAK1 (0.36) ATRSCN10ATSHRFSHRTGFBR1
SCHEMBL26152164 0.87 AAK1 (0.36) ATRSCN10ATSHRFSHRTGFBR1
SCHEMBL30418798 0.87 TRPV1 (0.36) TRPV1ATRHCRTR1METAP1P2RX7

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
CN-118251389-A Pyridyl derivatives as sodium channel activators 泽农医药公司 2024-06-25 CN disclosed
US-20230150972-A1 PYRIDINYL DERIVATIVES AS SODIUM CHANNEL ACTIVATORS XENON PHARMACEUTICALS INC. (CA) 2023-05-18 US disclosed
US-20230150972-A1 PYRIDINYL DERIVATIVES AS SODIUM CHANNEL ACTIVATORS XENON PHARMACEUTICALS INC. (CA) 2023-05-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230150972-A1 PYRIDINYL DERIVATIVES AS SODIUM CHANNEL ACTIVATORS SCN1B, SCN1A, SCN2B TRPV1 64/4885ATR 4311/4885HCRTR1 1949/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.