SCHEMBL3979253

SCHEMBL3979253

O=C(O)c1cc(C2CCCC2)ccc1NS(=O)(=O)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.67
MCL1 Q07820 7/20 0.64
BCL2A1 Q16548 6/20 0.64
METAP2 P50579 5/20 0.60
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
POLB P06746 1/20 0.54
KMT2A Q03164 1/20 0.54
ACMSD Q8TDX5 2/20 0.52
PTGES2 Q9H7Z7 1/20 0.51
ACLY P53396 1/20 0.50
PGAM1 P18669 1/20 0.49

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
SCHEMBL3984253 0.99 KDM1A (0.69) KDM1AMCL1BCL2A1METAP2MEN1
SCHEMBL4650217 0.83 KDM1A (0.71) KDM1AMCL1BCL2A1METAP2MEN1
SCHEMBL18151773 0.79 MCL1 (1.00) KDM1AMCL1BCL2A1MEN1ALDH1A1
SCHEMBL9326592 0.79 KDM1A (0.56) KDM1AMCL1BCL2A1MEN1ALDH1A1
SCHEMBL16495860 0.78 METAP2 (0.73) KDM1AMCL1BCL2A1METAP2ACLY
SCHEMBL4565923 0.76 METAP2 (0.69) MCL1BCL2A1METAP2MEN1POLB
SCHEMBL2009251 0.75 METAP2 (1.00) MCL1BCL2A1METAP2ALDH1A1
SCHEMBL1139356 0.75 ACLY (0.78) METAP2ACLY
SCHEMBL1466906 0.74 ALDH1A1 (0.72) MCL1METAP2MEN1ALDH1A1POLB
SCHEMBL4098914 0.73 ACMSD (0.53) KDM1AMCL1BCL2A1MEN1ALDH1A1

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 8 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 claimed
US-20040068012-A1 Sulfonamides having antiangiogenic and anticancer activity ABBOTT LABORATORIES 2004-04-08 US claimed
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
US-20040068012-A1 Sulfonamides having antiangiogenic and anticancer activity ABBOTT LABORATORIES 2004-04-08 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 (3 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 KDM1A 3419/4885MCL1 1545/4885BCL2A1 1450/4885
US-20040068012-A1 Sulfonamides having antiangiogenic and anticancer activity METAP2, METAP1, DNPEP KDM1A 3419/4885MCL1 1545/4885BCL2A1 1450/4885
US-20040157836-A1 Sulfonamides having antiangiogenic and anticancer activity METAP2, METAP1, DNPEP KDM1A 3419/4885MCL1 1545/4885BCL2A1 1450/4885

“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.