SCHEMBL4041004

SCHEMBL4041004

Nc1nc(Nc2ccc(N3CCOCC3)c(Cl)c2)nn1-c1ccccn1

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 15/20 0.74
KIT P10721 11/20 0.74
AXL P30530 6/20 0.61
IRAK4 Q9NWZ3 4/20 0.61
JAK2 O60674 2/20 0.61
ABL1 P00519 1/20 0.59
LCK P06239 1/20 0.59
LYN P07948 1/20 0.59
MET P08581 1/20 0.59
PDGFRB P09619 1/20 0.59
SRC P12931 1/20 0.59
FGFR3 P22607 1/20 0.59
KDR P35968 1/20 0.59
JAK3 P52333 1/20 0.59
TEK Q02763 1/20 0.59
KARS1 Q15046 1/20 0.59
AURKA O14965 2/20 0.56

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
SCHEMBL13963313 0.91 FLT3 (0.76) FLT3KITAXLIRAK4JAK2
SCHEMBL12845741 0.89 FLT3 (0.73) FLT3KITAXLIRAK4JAK2
SCHEMBL13963314 0.89 FLT3 (0.76) FLT3KITAXLIRAK4JAK2
SCHEMBL4040173 0.89 FLT3 (0.72) FLT3KITAXLIRAK4JAK2
SCHEMBL14399533 0.87 FLT3 (0.69) FLT3KITAXLIRAK4JAK2
SCHEMBL4038957 0.87 FLT3 (0.71) FLT3KITAXLIRAK4JAK2
SCHEMBL4037409 0.86 FLT3 (1.00) FLT3KITAXLIRAK4JAK2
SCHEMBL12780751 0.85 FLT3 (0.69) FLT3KITAXLIRAK4JAK2
SCHEMBL4038815 0.85 FLT3 (0.66) FLT3KITAXLIRAK4JAK2
SCHEMBL2088252 0.82 FLT3 (0.76) FLT3KITAXLIRAK4JAK2

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 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107531705-B Bicyclic ketone sulfonamide compounds 美国安进公司 2020-09-18 CN disclosed
CN-107531705-B Bicyclic ketone sulfonamide compounds 美国安进公司 2020-09-18 CN disclosed
US-10472356-B2 Bicyclic ketone sulfonamide compounds AMGEN INC. (US) 2019-11-12 US disclosed
US-7902239-B2 Diaminotriazoles useful as inhibitors of protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-03-08 US disclosed
US-7902239-B2 Diaminotriazoles useful as inhibitors of protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-03-08 US disclosed
EP-1641801-B9 BRIDGED N-ARYLSULFONYLPIPERIDINES AS GAMMA-SECRETASE INHIBITORS SCHERING CORP (US) 2009-02-25 EP disclosed
EP-1562589-B1 DIAMINOTRIAZOLES USEFUL AS INHIBITORS OF PROTEIN KINASES VERTEX PHARMA (US) 2009-01-07 EP disclosed
EP-1562589-B1 DIAMINOTRIAZOLES USEFUL AS INHIBITORS OF PROTEIN KINASES VERTEX PHARMA (US) 2009-01-07 EP disclosed
EP-1641801-B1 BRIDGED N-ARYLSULFONYLPIPERIDINES AS GAMMA-SECRETASE INHIBITORS SCHERING CORP (US) 2008-07-16 EP disclosed
US-7368457-B2 Bridged N-arylsulfonylpiperidines as gamma-secretase inhibitors SCHERING CORPORATION (US) 2008-05-06 US disclosed
US-20010056189-A1 Pyrazole substituted hydroxamic acid derivatives as cyclooxxgenase-2 and 5- lipoxygenase inhibitors TALLEY JOHN J (US) 2001-12-27 US disclosed
EP-0995747-A1 Substituted sulfonylphenylheterocycles as cyclooxygenase-2 and 5-lipoxygenase inhibitors G.D. SEARLE & CO. (US) 2000-04-26 EP disclosed
EP-0828736-A1 SUBSTITUTED SULFONYLPHENYLHETEROCYCLES AS CYCLOOXYGENASE-2 AND 5-LIPOXYGENASE INHIBITORS G.D. SEARLE & CO. (US) 1998-03-18 EP disclosed
EP-0828718-A1 HETEROCYCLO SUBSTITUTED HYDROXAMIC ACID DERIVATIVES AS CYCLOOXYGENASE-2 AND 5-LIPOXYGENASE INHIBITORS G.D. SEARLE & CO. (US) 1998-03-18 EP disclosed
US-5643933-A Substituted sulfonylphenylheterocycles as cyclooxygenase-2 and 5-lipoxygenase inhibitors G. D. SEARLE & CO. (US) 1997-07-01 US disclosed
WO-1996038418-A1 HETEROCYCLO SUBSTITUTED HYDROXAMIC ACID DERIVATIVES AS CYCLOOXYGENASE-2 AND 5-LIPOXYGENASE INHIBITORS G.D. SEARLE & CO. (US) 1996-12-05 WO disclosed
WO-1996038442-A1 SUBSTITUTED SULFONYLPHENYLHETEROCYCLES AS CYCLOOXYGENASE-2 AND 5-LIPOXYGENASE INHIBITORS G.D. SEARLE & CO. (US) 1996-12-05 WO disclosed
US-5356862-A Herbicidal sulfonylureas E. I. DU PONT DE NEMOURS AND COMPANY (US) 1994-10-18 US disclosed
EP-0511993-A1 HERBICIDAL SULFONYLUREAS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-11-11 EP disclosed
WO-1991010668-A1 HERBICIDAL SULFONYLUREAS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-07-25 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-10472356-B2 Bicyclic ketone sulfonamide compounds TRPV1, TRPA1, KCNJ11 FLT3 2540/4885KIT 3105/4885AXL 3170/4885
US-20010056189-A1 Pyrazole substituted hydroxamic acid derivatives as cyclooxxgenase-2 and 5- lipoxygenase inhibitors ALOX5, ALOX15, ALOX12 FLT3 2658/4885KIT 2583/4885AXL 3662/4885

“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.