SCHEMBL30262575

SCHEMBL30262575

CCOC(=O)[C@@](Cc1ccc(OC(F)(F)F)cc1)(OC[C@H]1O[C@@H](n2cnc3c(N)nc(Cl)nc32)[C@@H](F)[C@@H]1O)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NT5E P21589 20/20 1.00

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
SCHEMBL19948847 1.00 NT5E (1.00) NT5E
SCHEMBL19949007 1.00 NT5E (1.00) NT5E
SCHEMBL19948434 1.00 NT5E (1.00) NT5E
SCHEMBL30262566 1.00 NT5E (1.00) NT5E
SCHEMBL30115101 1.00 NT5E (1.00) NT5E
SCHEMBL30262587 0.98 NT5E (0.96) NT5E
SCHEMBL19948462 0.97 NT5E (0.94) NT5E
SCHEMBL30115190 0.97 NT5E (0.94) NT5E
SCHEMBL30115129 0.93 NT5E (1.00) NT5E
SCHEMBL19948503 0.93 NT5E (1.00) NT5E

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
CN-110234656-B Exonucleotidase inhibitors and methods of use thereof 卡利泰拉生物科技公司 2023-02-28 CN disclosed