SCHEMBL22941981

SCHEMBL22941981

CC#Cc1cc(C)c(C2C(=O)CC3(CCC(NC(=O)C(C)(C)C)CC3)CC2=O)c(C)c1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ALDH1A1 P00352 1/20 0.30
SSTR4 P31391 1/20 0.30
USP2 O75604 1/20 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
SCHEMBL22941560 0.94
SCHEMBL22941555 0.89 DRD2 (0.30)
SCHEMBL22942013 0.88 ALOX15 (0.34)
SCHEMBL22941600 0.87 JAK2 (0.34)
SCHEMBL22941983 0.86 SMYD3 (0.34) LMNA
SCHEMBL22941978 0.86 JAK2 (0.34)
SCHEMBL22941985 0.85
SCHEMBL22941526 0.84 KMT2A (0.31)
SCHEMBL22941528 0.84 KMT2A (0.31)
SCHEMBL22941559 0.83 NPSR1 (0.38) LMNANPSR1ALDH1A1

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
WO-2021018834-A1 CYCLIC DIONES AS HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2021-02-04 WO disclosed