SCHEMBL15024142

SCHEMBL15024142

C[C@H]1Cc2cc(Cl)ccc2[C@H]1Nc1cc(O[C@@H]2C[C@@H](CCS(N)(=O)=O)[C@@H](O)C2)ncn1

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NAE1 Q13564 20/20 0.52
UBA3 Q8TBC4 20/20 0.52
SAE1 Q9UBE0 1/20 0.30
UBA2 Q9UBT2 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
SCHEMBL15958749 0.91 NAE1 (0.55) NAE1UBA3
SCHEMBL15025759 0.90 NAE1 (0.51) NAE1UBA3
SCHEMBL16376870 0.89 NAE1 (0.66) NAE1UBA3
SCHEMBL14719789 0.80 NAE1 (0.68) NAE1UBA3
SCHEMBL29484028 0.80 NAE1 (0.68) NAE1UBA3
SCHEMBL14723085 0.80 NAE1 (0.68) NAE1UBA3
Hydrochloric Acid SCHEMBL14719845 0.80 NAE1 (0.67) NAE1UBA3
SCHEMBL14723289 0.79 NAE1 (0.53) NAE1UBA3
SCHEMBL783523 0.79 NAE1 (0.80) NAE1UBA3
SCHEMBL14719844 0.78 NAE1 (0.51) NAE1UBA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8809356-B2 Inhibitors of NEDD8-activating enzyme MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-19 US disclosed
US-20130150388-A1 INHIBITORS OF NEDD8-ACTIVATING ENZYME MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-06-13 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-20130150388-A1 INHIBITORS OF NEDD8-ACTIVATING ENZYME NEDD8, NAE1, UBA3 NAE1 2/4885UBA3 3/4885SAE1 36/4885

“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.