SCHEMBL29958536

SCHEMBL29958536

C=C(Cc1c(C)oc2c(N=C(c3ccccc3)c3ccccc3)cccc12)C(=O)NC

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 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
SCHEMBL21963701 0.80 TOP2A (0.36) GAA
SCHEMBL22010747 0.80 ESR1 (0.38) GAA
SCHEMBL24923371 0.76 ESR1 (0.32) GAA
SCHEMBL21963700 0.76 KMT2A (0.39) GAA
SCHEMBL25707381 0.75 LMNA (0.39) GAA
SCHEMBL21963757 0.74 EGFR (0.33) GAA
SCHEMBL28604517 0.73 ESR2 (0.39) GAA
SCHEMBL22010512 0.71 GBA1 (0.34) GAA
SCHEMBL21963733 0.67 KMT2A (0.46)
SCHEMBL7628959 0.62 CES1 (0.48)

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-115151541-A Novel compound and use thereof 德彪药业国际股份公司 2022-10-04 CN disclosed