SCHEMBL16388024

SCHEMBL16388024

O=C(c1cc(C(F)(F)F)n(Cc2cccc(Cl)c2)n1)c1cncnc1N[C@@H]1C[C@H](CO)[C@@H](O)[C@@H]1F

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SAE1 Q9UBE0 19/20 0.51
UBA2 Q9UBT2 19/20 0.51
NAE1 Q13564 16/20 0.51
UBA3 Q8TBC4 16/20 0.51
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39

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
SCHEMBL18277514 0.97 SAE1 (0.48) SAE1UBA2NAE1UBA3CA1
SCHEMBL18277405 0.91 SAE1 (0.46) SAE1UBA2NAE1UBA3CA1
SCHEMBL18295059 0.90 SAE1 (0.52) SAE1UBA2NAE1UBA3CA1
SCHEMBL16388023 0.90 SAE1 (0.66) SAE1UBA2NAE1UBA3
SCHEMBL18277084 0.82 SAE1 (0.48) SAE1UBA2NAE1UBA3CA1
SCHEMBL16388116 0.81 SAE1 (0.51) SAE1UBA2NAE1UBA3CA1
SCHEMBL19069918 0.81 SAE1 (0.53) SAE1UBA2NAE1UBA3
SCHEMBL18277159 0.81 SAE1 (0.48) SAE1UBA2NAE1UBA3CA1
SCHEMBL18294938 0.80 SAE1 (0.68) SAE1UBA2NAE1UBA3
SCHEMBL16388236 0.80 SAE1 (0.75) SAE1UBA2NAE1UBA3CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3016934-B1 HETEROARYL COMPOUNDS USEFUL AS INHIBITORS OF SUMO ACTIVATING ENZYME MILLENNIUM PHARM INC (US) 2018-01-10 EP disclosed
US-9695154-B2 Heteroaryl inhibitors of sumo activating enzyme MILLENNIUM PHARMACEUTICALS, INC. (US) 2017-07-04 US disclosed
US-9695154-B2 Heteroaryl inhibitors of sumo activating enzyme MILLENNIUM PHARMACEUTICALS, INC. (US) 2017-07-04 US disclosed
US-20160355504-A1 HETEROARYL INHIBITORS OF SUMO ACTIVATING ENZYME MILLENNIUM PHARMACEUTICALS, INC. (US) 2016-12-08 US disclosed
US-20160355504-A1 HETEROARYL INHIBITORS OF SUMO ACTIVATING ENZYME MILLENNIUM PHARMACEUTICALS, INC. (US) 2016-12-08 US disclosed
WO-2015002994-A2 HETEROARYL COMPOUNDS USEFUL AS INHIBITORS OF SUMO ACTIVATING ENZYME MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-01-08 WO 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-20160355504-A1 HETEROARYL INHIBITORS OF SUMO ACTIVATING ENZYME SAE1, SUMO2, SUMO1 SAE1 1/4885UBA2 4/4885NAE1 219/4885

“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.