SCHEMBL2001283

SCHEMBL2001283

Cc1n[nH]c(C)c1CCNC1=C(c2ccccc2)S(=O)(=O)N(C(C)C)C1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.37
MAPK1 P28482 2/20 0.37
KMT2A Q03164 3/20 0.35
HSD17B10 Q99714 6/20 0.34
ALDH1A1 P00352 2/20 0.34
SMN1; SMN2 Q16637 5/20 0.34
MAPT P10636 3/20 0.34
LMNA P02545 3/20 0.34
HTT P42858 3/20 0.34
TSHR P16473 1/20 0.34
RECQL P46063 1/20 0.34
GAA P10253 1/20 0.34
P2RX7 Q99572 3/20 0.34
CHEK1 O14757 1/20 0.33
AKT2 P31751 1/20 0.33
TTR P02766 1/20 0.33
MEN1 O00255 2/20 0.33
BRD4 O60885 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33

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
SCHEMBL2004430 0.82 KDM4E (0.36) KDM4EKMT2AALDH1A1TSHRGAA
SCHEMBL1996165 0.78 GSK3B (0.43) KDM4ESMN1; SMN2LMNAHTTGAA
SCHEMBL1998481 0.77 CDC25A (0.40) KDM4EMAPK1KMT2AALDH1A1SMN1; SMN2
SCHEMBL2000688 0.75 L3MBTL1 (0.40) KDM4EKMT2AHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL2000744 0.75 GBA1 (0.42) KMT2AALDH1A1SMN1; SMN2MAPTTSHR
SCHEMBL1999870 0.75 KMT2A (0.42) KMT2AALDH1A1LMNACYP2D6HPGD
SCHEMBL2002291 0.73 CA12 (0.38) KDM4EALDH1A1MAPTHPGD
SCHEMBL2002918 0.73 MTNR1A (0.41) KDM4ESMN1; SMN2LMNARECQLHPGD
SCHEMBL2001383 0.73 NOS3 (0.36) MAPK1KMT2ASMN1; SMN2GAAMEN1
SCHEMBL1998323 0.72 CA1 (0.46) KMT2AALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7723333-B2 Non-anilinic derivatives of isothiazol-3(2H)-one 1,1-dioxides as liver X receptor modulators ASTRAZENECA AB (SE) 2010-05-25 US claimed
US-20090005353-A1 Non-Anilinic Derivatives of Isothiazol-3(2H)-one 1,1-Dioxides as Liver X Receptor Modulators ASTRAZENECA AB (SE) 2009-01-01 US claimed
US-20230338314-A1 METHODS FOR THE TREATMENT OF MYELOID DERIVED SUPPRESSOR CELLS RELATED DISORDERS THE ROCKEFELLER UNIVERSITY (US) 2023-10-26 US disclosed
US-11648220-B2 Methods for the treatment of myeloid derived suppressor cells related disorders THE ROCKEFELLER UNIVERSITY (US) 2023-05-16 US disclosed
US-20190125745-A1 TREATMENT AND DIAGNOSIS OF CANCER RGENIX, INC. 2019-05-02 US disclosed
US-20190029984-A1 METHODS FOR THE TREATMENT OF MYELOID DERIVED SUPPRESSOR CELLS RELATED DISORDERS THE ROCKEFELLER UNIVERSITY (US) 2019-01-31 US disclosed
WO-2018222975-A1 METHODS FOR THE TREATMENT OF CANCER RGENIX, INC. (US) 2018-12-06 WO disclosed
EP-3402477-A2 METHODS FOR THE TREATMENT OF MYELOID DERIVED SUPPRESSOR CELLS RELATED DISORDERS The Rockefeller University (US) 2018-11-21 EP disclosed
WO-2017123568-A2 METHODS FOR THE TREATMENT OF MYELOID DERIVED SUPPRESSOR CELLS RELATED DISORDERS THE ROCKEFELLER UNIVERSITY (US) 2017-07-20 WO disclosed
US-7960380-B2 Non-anilinic derivatives of isothiazol-3(2H)-one 1,1-dioxides as liver X receptor modulators ASTRAZENECA AB (SE) 2011-06-14 US disclosed
US-20100227847-A1 Non-Anilinic Derivatives Of Isothiazol-3(2H)-one 1,1-Dioxides As Liver X Receptor Modulators ASTRAZENECA AB (SE) 2010-09-09 US disclosed
US-7723333-B2 Non-anilinic derivatives of isothiazol-3(2H)-one 1,1-dioxides as liver X receptor modulators ASTRAZENECA AB (SE) 2010-05-25 US disclosed
US-20090005353-A1 Non-Anilinic Derivatives of Isothiazol-3(2H)-one 1,1-Dioxides as Liver X Receptor Modulators ASTRAZENECA AB (SE) 2009-01-01 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 (6 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-20090005353-A1 Non-Anilinic Derivatives of Isothiazol-3(2H)-one 1,1-Dioxides as Liver X Receptor Modulators NR1H2, NR1H3, NR1I2 KDM4E 4359/4885MAPK1 955/4885KMT2A 2880/4885
US-11648220-B2 Methods for the treatment of myeloid derived suppressor cells related disorders NR1H3, NR1H2, MCL1 KDM4E 1602/4885MAPK1 1665/4885KMT2A 729/4885
US-20230338314-A1 METHODS FOR THE TREATMENT OF MYELOID DERIVED SUPPRESSOR CELLS RELATED DISORDERS NR1H3, NR1H2, MCL1 KDM4E 1602/4885MAPK1 1665/4885KMT2A 729/4885
US-20190029984-A1 METHODS FOR THE TREATMENT OF MYELOID DERIVED SUPPRESSOR CELLS RELATED DISORDERS NR1H3, NR1H2, MCL1 KDM4E 1602/4885MAPK1 1665/4885KMT2A 729/4885
US-20190125745-A1 TREATMENT AND DIAGNOSIS OF CANCER NR1H4, NR1H3, NR1H2 KDM4E 2159/4885MAPK1 4117/4885KMT2A 1900/4885
US-20100227847-A1 Non-Anilinic Derivatives Of Isothiazol-3(2H)-one 1,1-Dioxides As Liver X Receptor Modulators NR1H2, NR1H3, NR1I2 KDM4E 4359/4885MAPK1 955/4885KMT2A 2880/4885

“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.