SCHEMBL3981081

SCHEMBL3981081

Cc1ccc(S(=O)(=O)OC[C@@]2(C(C)(C)C)CCCN2C(=O)O)cc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
STAT3 P40763 1/20 0.39
ALDH1A1 P00352 5/20 0.38
HPGD P15428 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
APP P05067 3/20 0.38
GAA P10253 1/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CYP2C19 P33261 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 2/20 0.35
RAB9A P51151 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL143673 1.00 KMT2A (0.39) KMT2ASTAT3ALDH1A1HPGDNPSR1
SCHEMBL16538612 0.86 PSMD10 (0.39) KMT2ASTAT3ALDH1A1HPGDNPSR1
SCHEMBL16538626 0.86 PSMD10 (0.39) KMT2ASTAT3ALDH1A1HPGDNPSR1
SCHEMBL3479164 0.83 STAT3 (0.40) KMT2ASTAT3ALDH1A1HPGDNPSR1
SCHEMBL2446970 0.83 KMT2A (0.37) KMT2ASTAT3ALDH1A1HPGDNPSR1
SCHEMBL21381116 0.79
SCHEMBL28310610 0.79 KMT2A (0.43) KMT2ASTAT3ALDH1A1HPGDNPSR1
SCHEMBL28433251 0.78 GAA (0.41) KMT2AGAATSHRCYP2C19
SCHEMBL1319262 0.77 GAA (0.42) GAACYP2C19
SCHEMBL2446969 0.77 KMT2A (0.41) KMT2AALDH1A1HPGDNPSR1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7491718-B2 Sulfonamides having antiangiogenic and anticancer activity ABBOTT LABORATORIES (US) 2009-02-17 US disclosed
US-20040167128-A1 Sulfonamides having antiangiogenic and anticancer activity ABBVIE INC. 2004-08-26 US disclosed
US-20040157836-A1 Sulfonamides having antiangiogenic and anticancer activity ABBOTT LABORATORIES 2004-08-12 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 (2 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-20040167128-A1 Sulfonamides having antiangiogenic and anticancer activity METAP2, METAP1, DNPEP KMT2A 647/4885STAT3 2312/4885ALDH1A1 3463/4885
US-20040157836-A1 Sulfonamides having antiangiogenic and anticancer activity METAP2, METAP1, DNPEP KMT2A 647/4885STAT3 2312/4885ALDH1A1 3463/4885

“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.