SCHEMBL1442603

SCHEMBL1442603

CN(C)S(=O)(=O)c1ccccc1-c1ccc2ncc(N3CCCCC3)nc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 13/20 0.47
▸ FEN1 P39748 13/20 0.47
▸ PDPK1 O15530 1/20 0.45
▸ ROCK2 O75116 1/20 0.45
▸ FES P07332 1/20 0.45
▸ FER P16591 1/20 0.45
▸ MARK3 P27448 1/20 0.45
▸ FLT3 P36888 1/20 0.45
▸ MAP4K2 Q12851 1/20 0.45
▸ PKN2 Q16513 1/20 0.45
▸ CDC42BPA Q5VT25 1/20 0.45
▸ SLK Q9H2G2 1/20 0.45
▸ IRAK4 Q9NWZ3 1/20 0.45
▸ PIM2 Q9P1W9 1/20 0.45
▸ PIK3CA P42336 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ OPRM1 P35372 1/20 0.41

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
SCHEMBL1442742 0.90 HSD17B10 (0.47) ALOX5APFEN1PDPK1ROCK2FES
SCHEMBL1442456 0.83 PIK3CA (0.50) PIK3CAMEN1KMT2ANPSR1PTPN11
SCHEMBL13276189 0.83 PIK3CA (0.54) PIK3CA
SCHEMBL1442436 0.80 KDM4E (0.48) PIK3CAMEN1KMT2ASMN1; SMN2NPSR1
SCHEMBL1442702 0.79 CNR2 (0.46) ALOX5APPIK3CAMEN1KMT2ASMN1; SMN2
SCHEMBL1441751 0.79 PIK3CA (0.51) ALOX5APFEN1IRAK4PIK3CAPTPN11
SCHEMBL12812442 0.78 PTPN11 (0.45) ALOX5APFEN1PIK3CAMEN1KMT2A
SCHEMBL13276525 0.78 MTOR (0.48) ALOX5APFEN1PIK3CASMN1; SMN2PTPN11
SCHEMBL1442356 0.78 MAPT (0.52) ALOX5APFEN1PIM2PIK3CAMEN1
SCHEMBL1442797 0.78 HPGD (0.50) PIK3CAMEN1KMT2ASMN1; SMN2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9340528-B2 Substituted aminoquinoxalines as tyrosine threonine kinase inhibitors BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-05-17 — — US claimed
US-20120263708-A1 SUBSTITUTED AMINOQUINOXALINES AS TYROSINE THREONINE KINASE INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-10-18 — — US claimed
CN-102596932-A Substituted aminoquinoxalines as tyrosine threonine kinase inhibitors BAYER SCHERING PHARMA AG 2012-07-18 — — CN claimed
EP-2473498-A1 SUBSTITUTED AMINOQUINOXALINES AS TYROSINE THREONINE KINASE INHIBITORS Bayer Pharma Aktiengesellschaft (DE) 2012-07-11 — — EP claimed
WO-2011026579-A1 SUBSTITUTED AMINOQUINOXALINES AS TYROSINE THREONINE KINASE INHIBITORS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-03-10 — — WO claimed
US-9340528-B2 Substituted aminoquinoxalines as tyrosine threonine kinase inhibitors BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-05-17 — — US disclosed
US-9340528-B2 Substituted aminoquinoxalines as tyrosine threonine kinase inhibitors BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-05-17 — — US disclosed
US-9340528-B2 Substituted aminoquinoxalines as tyrosine threonine kinase inhibitors BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-05-17 — — US disclosed
US-20120263708-A1 SUBSTITUTED AMINOQUINOXALINES AS TYROSINE THREONINE KINASE INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-10-18 — — US disclosed
US-20120263708-A1 SUBSTITUTED AMINOQUINOXALINES AS TYROSINE THREONINE KINASE INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-10-18 — — US disclosed
US-20120263708-A1 SUBSTITUTED AMINOQUINOXALINES AS TYROSINE THREONINE KINASE INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-10-18 — — 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 (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-20120263708-A1 SUBSTITUTED AMINOQUINOXALINES AS TYROSINE THREONINE KINASE INHIBITORS ABL1, TYK2, JAK2 ALOX5AP 3864/4885FEN1 3646/4885PDPK1 253/4885

“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.

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