SCHEMBL20861650

SCHEMBL20861650

CC(C)C1OB(c2cc3c(cc2C=O)CCO3)OC1(C)C

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ERN1 O75460 3/20 0.34

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
SCHEMBL20861590 0.84 LMNA (0.39) —
SCHEMBL17397880 0.80 ERN1 (0.40) ERN1
SCHEMBL20861592 0.74 ERN1 (0.40) ERN1
SCHEMBL20861611 0.73 KDM4E (0.30) —
SCHEMBL20861759 0.68 GSK3B (0.33) —
SCHEMBL20861645 0.67 — —
SCHEMBL17822053 0.66 ERN1 (0.49) ERN1
SCHEMBL17397866 0.66 LMNA (0.37) ERN1
SCHEMBL25078221 0.63 P2RX7 (0.35) —
SCHEMBL24823392 0.62 ERN1 (0.48) ERN1

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
EP-3164404-B1 TRICYCLIC BENZOXABOROLES AS ANTIBACTERIAL AGENTS DAIICHI SANKYO CO LTD (JP) 2019-04-03 — — EP disclosed
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