SCHEMBL18571237

SCHEMBL18571237

CCCc1ccc(CS(=O)(=O)NC(C)C)cc1

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.46
MEN1 O00255 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HTT P42858 2/20 0.43
KMT2A Q03164 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ACACB O00763 2/20 0.40
FFAR4 Q5NUL3 1/20 0.40
PLK1 P53350 1/20 0.40
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HPGD P15428 1/20 0.38
NR3C1 P04150 1/20 0.38
GAA P10253 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
SCHEMBL18571231 0.85 KMT2A (0.45) CA2MEN1ALDH1A1HTTKMT2A
SCHEMBL16000110 0.81 ALDH1A1 (0.45) CA2MEN1ALDH1A1HTTKMT2A
SCHEMBL13234055 0.80 KMT2A (0.49) CA2MEN1ALDH1A1HTTKMT2A
SCHEMBL5121672 0.80 PSIP1 (0.44) CA2MEN1ALDH1A1HTTKMT2A
SCHEMBL5121670 0.80 ALDH1A1 (0.44) CA2MEN1ALDH1A1HTTKMT2A
SCHEMBL16000109 0.80 KDM4E (0.50) MEN1ALDH1A1HTTKMT2AL3MBTL1
SCHEMBL18571269 0.80 ALDH1A1 (0.44) MEN1ALDH1A1HTTKMT2ANPSR1
SCHEMBL18571235 0.80 KMT2A (0.44) MEN1ALDH1A1HTTKMT2ANPSR1
SCHEMBL2993430 0.80 ALDH1A1 (0.44) CA2MEN1ALDH1A1HTTKMT2A
SCHEMBL24425775 0.79 CA2 (0.50) CA2MEN1ALDH1A1HTTKMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11332443-B2 Derivatives of halo quinabactin THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-05-17 US disclosed
WO-2017034982-A1 DERIVATIVES OF HALO QUINABACTIN THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-03-02 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-11332443-B2 Derivatives of halo quinabactin HDHD5, HSF1, NQO2 CA2 995/4885MEN1 4584/4885ALDH1A1 2607/4885

“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.