SCHEMBL22637576

SCHEMBL22637576

C[C@H](NC(=O)c1cc(C(F)(F)F)nn1C)c1nc(-c2ccnc(C(F)(F)F)c2)no1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNT1 Q5JUK3 20/20 1.00
KCNQ1 P51787 1/20 1.00
KCNH2 Q12809 1/20 1.00
CACNA1C Q13936 1/20 1.00
SCN5A Q14524 1/20 1.00
KCNMB1 Q16558 1/20 1.00
KCNT2 Q6UVM3 1/20 1.00

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
SCHEMBL22637578 1.00 KCNT1 (1.00) KCNT1KCNQ1KCNH2CACNA1CSCN5A
SCHEMBL24660636 1.00 KCNT1 (1.00) KCNT1KCNQ1KCNH2CACNA1CSCN5A
SCHEMBL29463490 1.00 KCNT1 (1.00) KCNT1KCNQ1KCNH2CACNA1CSCN5A
SCHEMBL24660192 0.93 KCNT1 (0.86) KCNT1KCNQ1KCNH2CACNA1CSCN5A
SCHEMBL24660722 0.93 KCNT1 (1.00) KCNT1KCNQ1KCNH2CACNA1CSCN5A
SCHEMBL24660543 0.93 KCNT1 (1.00) KCNT1KCNQ1KCNH2CACNA1CSCN5A
SCHEMBL24660574 0.93 KCNT1 (1.00) KCNT1KCNQ1KCNH2CACNA1CSCN5A
SCHEMBL22637968 0.92 KCNT1 (1.00) KCNT1KCNQ1KCNH2CACNA1CSCN5A
SCHEMBL22637970 0.92 KCNT1 (1.00) KCNT1KCNQ1KCNH2CACNA1CSCN5A
SCHEMBL29463530 0.92 KCNT1 (1.00) KCNT1KCNQ1KCNH2CACNA1CSCN5A

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
WO-2023239839-A1 KCNT1 INHIBITORS COMPRISING AN ISOXAZOLE OR OXADIAZOLE CORE AND METHODS OF USE PRAXIS PRECISION MEDICINES, INC. (US) 2023-12-14 WO disclosed
US-20220259193-A1 KCNT1 INHIBITORS AND METHODS OF USE PRAXIS PRECISION MEDICINES, INC. (US) 2022-08-18 US disclosed
CN-114269340-A KCNT1 inhibitors and methods of use 普拉克西斯精密药物股份有限公司 2022-04-01 CN disclosed
EP-3962481-A1 KCNT1 INHIBITORS AND METHODS OF USE Praxis Precision Medicines, Inc. (US) 2022-03-09 EP disclosed
WO-2020227101-A1 KCNT1 INHIBITORS AND METHODS OF USE PRAXIS PRECISION MEDICINES, INC. (US) 2020-11-12 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 (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-20220259193-A1 KCNT1 INHIBITORS AND METHODS OF USE KCNT1, KCNT2, KCNQ2 KCNT1 1/4885KCNQ1 4/4885KCNH2 33/4885

“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.