SCHEMBL2065995

SCHEMBL2065995

COc1ccc2ncc(S(N)(=O)=O)n2n1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TNF P01375 6/20 0.61
DYRK1A Q13627 7/20 0.48
DYRK3 O43781 6/20 0.48
DYRK2 Q92630 6/20 0.48
DYRK1B Q9Y463 5/20 0.48
CCNT1 O60563 4/20 0.48
CDK9 P50750 4/20 0.48
CCNA2 P20248 3/20 0.46
CDK2 P24941 3/20 0.46
CDK5 Q00535 3/20 0.42
CDK5R1 Q15078 3/20 0.42
FYN P06241 1/20 0.39
KDM4E B2RXH2 2/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
MKNK1 Q9BUB5 2/20 0.35

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
SCHEMBL2066384 0.85 TNF (0.47) TNFDYRK1ADYRK3DYRK2DYRK1B
SCHEMBL2065978 0.80 TNF (0.67) TNFKDM4ECA1CA2
SCHEMBL2067972 0.76 TNF (0.61) TNF
SCHEMBL2066640 0.76 TNF (0.61) TNFFYNCA1CA2
SCHEMBL22834762 0.76 DYRK1A (0.57) TNFDYRK1ADYRK3DYRK2DYRK1B
SCHEMBL2064906 0.74 TNF (0.58) TNFFYNCA2
SCHEMBL2066936 0.72 TNF (0.57) TNFKDM4EHPGDHSD17B10
SCHEMBL15973521 0.72 DYRK1A (0.51) TNFDYRK1ADYRK3DYRK2DYRK1B
SCHEMBL9518763 0.72 KDM4E (0.41) DYRK1ADYRK3DYRK2DYRK1BCCNT1
SCHEMBL2066977 0.71 TNF (0.56) TNFCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8148524-B2 Process for producing sulfonyl chloride compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-04-03 US disclosed
EP-1932846-B1 METHOD FOR PRODUCING SULFONYL CHLORIDE COMPOUND SUMITOMO CHEMICAL CO (JP) 2010-10-27 EP disclosed
US-20090247748-A1 PROCESS FOR PRODUCING SULFONYL CHLORIDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-10-01 US disclosed
EP-1932846-A1 METHOD FOR PRODUCING SULFONYL CHLORIDE COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-06-18 EP 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-20090247748-A1 PROCESS FOR PRODUCING SULFONYL CHLORIDE COMPOUND SALL4, CLCN2, CLIC1 TNF 4785/4885DYRK1A 1927/4885DYRK3 1811/4885

“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.