SCHEMBL22955481

SCHEMBL22955481

CC#Cc1cc(C)c(C2C(=O)CC(C(=O)N3CCC(=O)CC3)CC2=O)c(C)c1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL22954924 0.91 KMT2A (0.36) TSHR
SCHEMBL22955488 0.88 ACACB (0.33) TSHR
SCHEMBL22954918 0.87 TDP1 (0.36) TSHR
SCHEMBL22955480 0.86 SPR (0.30)
SCHEMBL22954942 0.82 CNR1 (0.34) TSHR
SCHEMBL22955549 0.80 RECQL (0.35)
SCHEMBL22955465 0.80 PIK3CA (0.32)
SCHEMBL22955124 0.78 KDM1A (0.35)
SCHEMBL22954912 0.77 CYP11B2 (0.30)
SCHEMBL21332010 0.76 ALDH1A1 (0.34)

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-2021018833-A1 CYCLOHEXANEDIONES AS HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2021-02-04 WO disclosed