SCHEMBL3978587

SCHEMBL3978587

Cc1c(C#N)ccc(NS(=O)(=O)c2ccccc2)c1C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.55
GAA P10253 2/20 0.55
HTT P42858 1/20 0.55
METAP2 P50579 13/20 0.54
METAP1 P53582 1/20 0.54
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
HPGD P15428 1/20 0.47
ALOX15 P16050 1/20 0.47
HSD17B10 Q99714 1/20 0.47
SLC22A12 Q96S37 1/20 0.46

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
SCHEMBL3985688 0.87 CYP3A4 (0.49) ALDH1A1GAAHTTMETAP2METAP1
SCHEMBL4272722 0.83 METAP2 (0.69) METAP2
SCHEMBL3985666 0.83 TP53 (0.48) ALDH1A1GAAHTTMETAP2METAP1
SCHEMBL18299151 0.81 ALDH1A1 (0.50) ALDH1A1GAAHTTMETAP2KMT2A
SCHEMBL3981261 0.80 ALDH1A1 (0.58) ALDH1A1GAAHTTMETAP2METAP1
SCHEMBL3986500 0.71 METAP2 (1.00) ALDH1A1GAAHTTMETAP2METAP1
SCHEMBL6570647 0.70 MCL1 (0.54) ALDH1A1GAAHTTMETAP2KMT2A
SCHEMBL11138283 0.70 AR (0.38) ALDH1A1HPGD
SCHEMBL31125442 0.70 AR (0.38) ALDH1A1HPGD
SCHEMBL21865747 0.70 RXFP1 (0.55) ALDH1A1GAAHTTMETAP2KMT2A

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 5 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
EP-1549613-A1 SULFONAMIDES HAVING ANTIANGIOGENIC AND ANTICANCER ACTIVITY Abbott Laboratories (US) 2005-07-06 EP 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
WO-2004033419-A1 SULFONAMIDES HAVING ANTIANGIOGENIC AND ANTICANCER ACTIVITY ABBOTT LABORATORIES (US) 2004-04-22 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 (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 ALDH1A1 3463/4885GAA 1250/4885HTT 4102/4885
US-20040157836-A1 Sulfonamides having antiangiogenic and anticancer activity METAP2, METAP1, DNPEP ALDH1A1 3463/4885GAA 1250/4885HTT 4102/4885

“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.