SCHEMBL25848955

SCHEMBL25848955

CC(C)(C#N)c1ccc(CNC(=O)c2ccc(S(C)(=O)=O)s2)cc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 11/20 0.46
NR1H4 Q96RI1 7/20 0.46
RORC P51449 1/20 0.41
HDAC3 O15379 4/20 0.41
HDAC1 Q13547 3/20 0.41
HDAC6 Q9UBN7 3/20 0.41
HDAC4 P56524 2/20 0.41
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
HDAC8 Q9BY41 1/20 0.39
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL25848951 0.89 EPHX2 (0.42) EPHX2NR1H4RORCHDAC3HDAC1
SCHEMBL25848846 0.89 EPHX2 (0.46) EPHX2NR1H4HDAC3HDAC1HDAC6
SCHEMBL25848823 0.87 EPHX2 (0.61) EPHX2NR1H4HDAC3HDAC6CA1
SCHEMBL25848940 0.83 LSS (0.50) EPHX2NR1H4RORCHDAC3HDAC1
SCHEMBL25848839 0.80 ALDH1A1 (0.49) HDAC3HDAC1HDAC6HDAC4MEN1
SCHEMBL25848841 0.78 EPHX2 (0.42) EPHX2NR1H4HDAC3HDAC1HDAC6
SCHEMBL25848811 0.77 SMN1; SMN2 (0.51) EPHX2NR1H4HDAC3HDAC1HDAC6
SCHEMBL24196149 0.76 HDAC3 (0.44) EPHX2NR1H4HDAC3HDAC1HDAC6
SCHEMBL24196383 0.75 EPHX2 (0.42) EPHX2NR1H4HDAC3HDAC1HDAC6
SCHEMBL25848828 0.75 EPHX2 (0.53) EPHX2NR1H4HDAC3HDAC6CA1

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
US-20230219921-A1 KCNT1 INHIBITORS AND METHODS OF USE PRAXIS PRECISION MEDICINES, INC. 2023-07-13 US disclosed
US-20230219921-A1 KCNT1 INHIBITORS AND METHODS OF USE PRAXIS PRECISION MEDICINES, INC. 2023-07-13 US disclosed
EP-4175624-A1 KCNT1 INHIBITORS AND METHODS OF USE Praxis Precision Medicines, Inc. (US) 2023-05-10 EP disclosed
CN-116075297-A KCNT1 inhibitors and methods of use 普拉西斯精密医药公司 2023-05-05 CN 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-20230219921-A1 KCNT1 INHIBITORS AND METHODS OF USE KCNT1, KCNT2, KCNQ2 EPHX2 2590/4885NR1H4 3085/4885RORC 4639/4885

“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.