SCHEMBL14029357

SCHEMBL14029357

C=CS(=O)(=O)CCNc1nc(NCCOS(=O)(=O)O)c(/N=N/c2ccc(-c3ccc(/N=N/c4c(NCCOS(=O)(=O)O)nc(NCCS(=O)(=O)C=C)c(N)c4C)cc3S(=O)(=O)O)c(S(=O)(=O)O)c2)c(C)c1N

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SENP2 Q9HC62 3/20 0.32
▸ SENP1 Q9P0U3 3/20 0.32
▸ SUMO2 P61956 2/20 0.32
▸ SUMO1 P63165 2/20 0.32
▸ SENP7 Q9BQF6 2/20 0.32
▸ SENP3 Q9H4L4 2/20 0.32
▸ THRB P10828 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
SCHEMBL14029354 0.94 MAPK8 (0.30) —
SCHEMBL14029351 0.94 MAPK8 (0.30) —
SCHEMBL14029536 0.89 ENPP2 (0.39) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL14004339 0.89 MAPT (0.31) —
SCHEMBL14004342 0.89 MAPT (0.31) —
SCHEMBL14004333 0.89 MAPT (0.31) —
SCHEMBL14029568 0.82 ENPP2 (0.43) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL14004348 0.81 SENP2 (0.36) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL14004343 0.81 SENP2 (0.36) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL14004340 0.81 SENP2 (0.36) SENP2SENP1SUMO2SUMO1SENP7

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-20080289124-A1 Reactive Azo Dyes, Methods for the Production Thereof and Their Use DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2008-11-27 — — 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-20080289124-A1 Reactive Azo Dyes, Methods for the Production Thereof and Their Use IK, CYP1A1, ALKBH1 SENP2 3998/4885SENP1 3063/4885SUMO2 4056/4885

“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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