SCHEMBL21789258

SCHEMBL21789258

CC(C)(C)OC(=O)Nc1cnc(Cl)c(F)c1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATR Q13535 1/20 0.41
RXFP1 Q9HBX9 1/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
METAP1 P53582 1/20 0.37
P2RX3 P56373 1/20 0.36
AAK1 Q2M2I8 1/20 0.36
MAPKAPK2 P49137 2/20 0.35
CYP17A1 P05093 1/20 0.35
SYK P43405 1/20 0.35
S1PR3 Q99500 1/20 0.35
NAMPT P43490 1/20 0.35
RORC P51449 1/20 0.35
HSP90AA1 P07900 1/20 0.35
HSP90AB1 P08238 1/20 0.35
ELANE P08246 1/20 0.35
TRPA1 O75762 1/20 0.34
LCK P06239 1/20 0.34
STK17B O94768 1/20 0.34
STK17A Q9UEE5 1/20 0.34

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
SCHEMBL19960768 0.84 ATR (0.43) ATRMETAP1P2RX3AAK1MAPKAPK2
SCHEMBL30038835 0.83 ATR (0.42) ATRRXFP1METAP1P2RX3AAK1
SCHEMBL23291067 0.83 ATR (0.42) ATRRXFP1METAP1P2RX3AAK1
SCHEMBL2019695 0.83 ATR (0.42) ATRRXFP1METAP1P2RX3AAK1
SCHEMBL26697706 0.82 ATR (0.41) ATRMETAP1P2RX3AAK1MAPKAPK2
SCHEMBL29936130 0.81 ATR (0.41) ATRMETAP1P2RX3AAK1MAPKAPK2
SCHEMBL26894606 0.81 ATR (0.41) ATRMETAP1P2RX3AAK1MAPKAPK2
SCHEMBL21773064 0.80 XPO1 (0.35)
SCHEMBL29936019 0.80 ATR (0.40) ATRRXFP1METAP1P2RX3AAK1
SCHEMBL30722754 0.80 ATR (0.40) ATRRXFP1METAP1P2RX3AAK1

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
CN-112638898-B Heteroaryl substituted sulfonamide compounds and their use as sodium channel inhibitors 泽农医药公司 2024-04-09 CN disclosed
US-10752623-B2 Heteroaryl-substituted sulfonamide compounds and their use as sodium channel inhibitors XENON PHARMACEUTICALS INC. (CA) 2020-08-25 US disclosed
US-20200071313-A1 HETEROARYL-SUBSTITUTED SULFONAMIDE COMPOUNDS AND THEIR USE AS SODIUM CHANNEL INHIBITORS XENON PHARMACEUTICALS INC. (CA) 2020-03-05 US disclosed
WO-2020047312-A1 HETEROARYL-SUBSTITUTED SULFONAMIDE COMPOUNDS AND THEIR USE AS SODIUM CHANNEL INHIBITORS XENON PHARMACEUTICALS INC. (CA) 2020-03-05 WO 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 (2 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-20200071313-A1 HETEROARYL-SUBSTITUTED SULFONAMIDE COMPOUNDS AND THEIR USE AS SODIUM CHANNEL INHIBITORS SCN1A, SCN2A, SCN2B ATR 4250/4885RXFP1 3876/4885LMNA 1432/4885
US-10752623-B2 Heteroaryl-substituted sulfonamide compounds and their use as sodium channel inhibitors SCN1A, SCN2A, SCN2B ATR 4250/4885RXFP1 3876/4885LMNA 1432/4885

“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.