SCHEMBL29951986

SCHEMBL29951986

OB(O)c1cn(CC2CC2)cc1Cl

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 3/20 0.33
KDM2B Q8NHM5 3/20 0.32
PHF8 Q9UPP1 1/20 0.31
GRM2 Q14416 1/20 0.30
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 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
SCHEMBL29955330 0.75
SCHEMBL2560175 0.69
SCHEMBL29954632 0.68 SIGMAR1 (0.39)
SCHEMBL2560171 0.68 ALDH1A1 (0.31)
SCHEMBL29951297 0.66 CA12 (0.44) CA12CA1CA2CA9
SCHEMBL29952546 0.66 GAA (0.33) KDM2B
SCHEMBL29954484 0.63
SCHEMBL16972901 0.60 PHF8 (0.45) WDR5KDM2BPHF8GRM2CA12
SCHEMBL10208371 0.60 CA12 (0.39) CA12CA1CA2CA9
SCHEMBL29956010 0.59

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