SCHEMBL23736038

SCHEMBL23736038

CCC(C)[C@H](N)C(=O)N(C)[C@@H]1C(=O)N[C@@H](C)C(=O)NC(C(=O)OC)Cc2ccc(OC)c(c2)-c2cc1ccc2OC

nearest known ligand 0.42

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ IARS1 P41252 1/20 0.31

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
SCHEMBL806691 0.85 GAA (0.33) —
SCHEMBL26481205 0.84 HDAC3 (0.33) —
SCHEMBL23736080 0.83 HDAC3 (0.34) —
SCHEMBL15727144 0.82 PDE4B (0.34) —
SCHEMBL15727211 0.82 CCNT1 (0.35) —
SCHEMBL15750389 0.81 CCNT1 (0.34) —
SCHEMBL15253607 0.81 CCNT1 (0.34) —
SCHEMBL806626 0.79 CCNT1 (0.33) —
SCHEMBL15750364 0.79 CCNT1 (0.34) —
SCHEMBL25982682 0.79 CA12 (0.32) —

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-2922829-B1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS RQX PHARMACEUTICALS INC (US) 2021-08-11 — — EP disclosed
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