SCHEMBL29956060

SCHEMBL29956060

OB(O)c1cccc2oncc12

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.42
ENPP2 Q13822 1/20 0.31
TP53 P04637 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
HIF1A Q16665 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
SCHEMBL2005193 0.75 BRD4 (0.42) BRD4SMN1; SMN2HIF1A
SCHEMBL20871562 0.69 BRD4 (0.41) BRD4
SCHEMBL2736863 0.69 CYP3A4 (0.44) BRD4SMN1; SMN2HIF1A
SCHEMBL21026104 0.69 BRD4 (0.42) BRD4
SCHEMBL21807206 0.69 LMNA (0.41) BRD4TP53SMN1; SMN2HIF1A
SCHEMBL24399382 0.69 BRD4 (0.42) BRD4SMN1; SMN2
SCHEMBL30712749 0.69 BRD4 (0.60) BRD4TP53HIF1A
SCHEMBL2399704 0.69 MAPT (0.44) ENPP2
SCHEMBL29595177 0.69 MAPT (0.44) ENPP2
SCHEMBL2330838 0.68 MAOA (0.41) ENPP2

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