SCHEMBL7033718

SCHEMBL7033718

CC(CC[C@@H](C)c1ccc(-c2ccc(N)c(N)c2)cc1)S(N)(=O)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
GRIA4 P48058 8/20 0.40
GAA P10253 2/20 0.36
PKM P14618 2/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP17A1 P05093 2/20 0.35
CYP19A1 P11511 2/20 0.35
CYP11B1 P15538 2/20 0.35
CYP11B2 P19099 2/20 0.35
GRIA1 P42261 1/20 0.32
GRIA2 P42262 1/20 0.32
GRIA3 P42263 1/20 0.32
CYP3A4 P08684 1/20 0.32
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL7026831 1.00 MEN1 (0.40) MEN1KMT2ATDP1GRIA4GAA
SCHEMBL7045948 0.84 ALOX5AP (0.39) MEN1KMT2AHPGDCYP3A4MAPT
SCHEMBL7028294 0.83 MAPT (0.52) MEN1KMT2ATDP1GRIA4GAA
SCHEMBL5878043 0.80 GRIA4 (0.46) TDP1GRIA4GAAPKMUSP2
SCHEMBL7033714 0.78 MEN1 (0.38) MEN1KMT2ATDP1GRIA4GAA
SCHEMBL7032122 0.76 GRIA4 (0.42) MEN1KMT2ATDP1GRIA4GAA
SCHEMBL6759322 0.75 TAAR1 (0.48)
SCHEMBL7050800 0.71 TDP1 (0.43) MEN1KMT2ATDP1PKMALDH1A1
SCHEMBL20681899 0.70 TDP1 (0.61) MEN1KMT2ATDP1GAAALDH1A1
SCHEMBL7028198 0.69 CA1 (0.49)

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-20030225127-A1 Heterocyclic sulfonamide derivatives BENDER DAVID MICHAEL (US) 2003-12-04 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-20030225127-A1 Heterocyclic sulfonamide derivatives GRIN2A, GRIN2B, GRIN1 MEN1 4088/4885KMT2A 915/4885TDP1 3131/4885

“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.