SCHEMBL29951746

SCHEMBL29951746

CC(C=O)Cn1cccc1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.31
TSHR P16473 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
SCHEMBL543453 0.73 TP53 (0.31) TP53
SCHEMBL26063735 0.73 FDPS (0.49) TSHR
SCHEMBL7350679 0.68 TP53 (0.31) TP53
SCHEMBL7991895 0.67
SCHEMBL28124381 0.67 KDM4E (0.30)
SCHEMBL7647881 0.67
SCHEMBL537360 0.67
SCHEMBL536767 0.67
SCHEMBL536783 0.67
SCHEMBL25661035 0.65 CYP1A2 (0.43)

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
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed