SCHEMBL25848869

SCHEMBL25848869

Cc1cc(C(C)F)ccc1CNC(=O)c1ccc(S(C)(=O)=O)s1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ELANE P08246 6/20 0.39
TRPV1 Q8NER1 2/20 0.36
HRH1 P35367 1/20 0.36
CCR3 P51677 1/20 0.36
HDAC1 Q13547 3/20 0.35
HDAC6 Q9UBN7 3/20 0.35
EPHX2 P34913 2/20 0.34
ALDH1A1 P00352 1/20 0.34
BTK Q06187 2/20 0.34
HDAC4 P56524 2/20 0.33
MAOB P27338 1/20 0.33
HDAC3 O15379 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
SCHEMBL30393777 0.94 ELANE (0.43) ELANETRPV1HRH1CCR3HDAC1
SCHEMBL24196156 0.94 ELANE (0.43) ELANETRPV1HRH1CCR3HDAC1
SCHEMBL25848866 0.83 HDAC3 (0.43) ELANEHRH1CCR3HDAC1HDAC6
SCHEMBL25848970 0.82 EPHX2 (0.44) ELANEHDAC1HDAC6EPHX2HDAC4
SCHEMBL25848857 0.81 EPHX2 (0.45) ELANEHDAC1HDAC6EPHX2BTK
SCHEMBL24196672 0.80 ELANE (0.40) ELANETRPV1HDAC1HDAC6EPHX2
SCHEMBL24196149 0.77 HDAC3 (0.44) ELANEHRH1CCR3HDAC1HDAC6
SCHEMBL25848811 0.76 SMN1; SMN2 (0.51) HRH1CCR3HDAC1HDAC6EPHX2
SCHEMBL25848762 0.75 HDAC1 (0.46) HRH1CCR3HDAC1HDAC6EPHX2
SCHEMBL25304798 0.74 NAMPT (0.41) ELANETRPV1HDAC1HDAC6EPHX2

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 1 patent. 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

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 ELANE 4457/4885TRPV1 330/4885HRH1 1751/4885

“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.