SCHEMBL866983

SCHEMBL866983

CC(C)(C)[Si](C)(C)O[C@H]1C[C@H](c2csc3c(NCC4CCCCC4)ncnc23)C[C@H]1COS(N)(=O)=O

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAE1 Q13564 5/20 0.37
UBA3 Q8TBC4 5/20 0.37
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
GPR119 Q8TDV5 1/20 0.32
SAE1 Q9UBE0 2/20 0.31
UBA2 Q9UBT2 2/20 0.31
LPAR1 Q92633 1/20 0.30
LPAR2 Q9HBW0 1/20 0.30

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
SCHEMBL10149582 0.88 JAK2 (0.32) JAK2JAK1GPR119
SCHEMBL865900 0.87 JAK2 (0.32) JAK2JAK1GPR119
SCHEMBL865901 0.87 JAK2 (0.32) JAK2JAK1GPR119
SCHEMBL866507 0.84 NAE1 (0.44) NAE1UBA3SAE1UBA2
SCHEMBL865836 0.84 NAE1 (0.44) NAE1UBA3SAE1UBA2
SCHEMBL867174 0.83 NAE1 (0.44) NAE1UBA3SAE1UBA2
SCHEMBL867353 0.83 NAE1 (0.44) NAE1UBA3SAE1UBA2
SCHEMBL866982 0.83 GPR119 (0.35) NAE1UBA3JAK2JAK1GPR119
SCHEMBL867408 0.81 JAK2 (0.31) JAK2JAK1
SCHEMBL10184262 0.72 JAK2 (0.33) JAK2JAK1GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120077814-A1 SULFONAMIDE, SULFAMATE, AND SULFAMOTHIOATE DERIVATIVES WANG ZHONG (US) 2012-03-29 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-20120077814-A1 SULFONAMIDE, SULFAMATE, AND SULFAMOTHIOATE DERIVATIVES NEDD8, NAE1, UBA3 NAE1 2/4885UBA3 3/4885JAK2 3571/4885

“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.