SCHEMBL4896083

SCHEMBL4896083

CC(=O)c1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.74
KMT2A Q03164 6/20 0.74
ALDH1A1 P00352 5/20 0.74
HPGD P15428 3/20 0.74
KDM4E B2RXH2 1/20 0.74
CYP3A4 P08684 1/20 0.74
TDP1 Q9NUW8 1/20 0.74
MAPT P10636 4/20 0.68
GAA P10253 3/20 0.68
POLB P06746 2/20 0.68
CA12 O43570 2/20 0.66
CA9 Q16790 2/20 0.66
MAPK1 P28482 2/20 0.65
LMNA P02545 5/20 0.64
SMN1; SMN2 Q16637 3/20 0.64
CA2 P00918 2/20 0.64
NPC1 O15118 1/20 0.64
CA1 P00915 1/20 0.64
ALOX12 P18054 2/20 0.60
HDAC1 Q13547 1/20 0.59

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
SCHEMBL5330654 0.87 CA2 (0.69) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL7498033 0.86 CA2 (0.83) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL8273562 0.86 POLB (0.72) MEN1KMT2AALDH1A1HPGDKDM4E
Sulfanitran SCHEMBL93837 0.85 KMT2A (1.00) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL23093556 0.85 ALDH1A1 (0.62) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL14288331 0.84 HDAC1 (0.64) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL23093376 0.83 KDM1A (0.62) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL5315455 0.83 HDAC3 (0.73) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL6577363 0.81 CA2 (0.71) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL12338982 0.81 MAPT (1.00) MEN1KMT2AALDH1A1HPGDMAPT

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-20240059658-A1 QUINOLINE DERIVATIVES AND USES IN MANAGING CANCER UNIV EMORY (US) 2024-02-22 US disclosed
WO-2021050721-A1 QUINOLINE DERIVATIVES AND USES IN MANAGING CANCER EMORY UNIVERSITY (US) 2021-03-18 WO disclosed
US-20080293970-A1 Process for Synthesis of 4-4'-Diamino-Diphenyl-Sulfone LUNDBECK PHARMACEUTICALS ITALY S.P.A. 2008-11-27 US disclosed
EP-1778630-A1 PROCESS FOR SYNTHESIS OF 4-4'-DIAMINO-DIPHENYL-SULFONE Lundbeck Pharmaceuticals Italy S.P.A. (IT) 2007-05-02 EP disclosed
WO-2006002690-A1 PROCESS FOR SYNTHESIS OF 4-4'-DIAMINO-DIPHENYL-SULFONE LUNDBECK PHARMACEUTICALS ITALY S.P.A. (IT) 2006-01-12 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-20240059658-A1 QUINOLINE DERIVATIVES AND USES IN MANAGING CANCER MDM2, TP53, RECQL MEN1 1224/4885KMT2A 651/4885ALDH1A1 1022/4885

“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.