SCHEMBL23837520

SCHEMBL23837520

CC(=O)CCC(=O)N[C@H]1Cc2cccc(C(=O)OCI)c2OB1O

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 3/20 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
SCHEMBL23837371 0.94 MAPT (0.32) —
SCHEMBL17337323 0.91 TSHR (0.36) —
SCHEMBL17337325 0.91 TSHR (0.36) —
SCHEMBL23837551 0.91 TRPA1 (0.32) —
SCHEMBL17337206 0.90 LMNA (0.38) PARP1
SCHEMBL17337203 0.90 LMNA (0.38) PARP1
SCHEMBL23130045 0.90 — —
SCHEMBL23837524 0.90 TSHR (0.30) —
SCHEMBL17337319 0.89 PRKCB (0.31) —
SCHEMBL17347857 0.89 ALDH1A1 (0.39) —

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-3882252-A1 BETA-LACTAMASE INHIBITORS Venatorx Pharmaceuticals, Inc. (US) 2021-09-22 — — EP disclosed
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