SCHEMBL29956923

SCHEMBL29956923

Nc1oc2ccc(F)cc2c(=O)c1C=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 1.00
MEN1 O00255 2/20 1.00
LMNA P02545 1/20 1.00
ALPG P10696 1/20 0.68
MAPK1 P28482 1/20 0.63
KDM4E B2RXH2 3/20 0.62
THRB P10828 1/20 0.62
PTPN1 P18031 1/20 0.51
NQO1 P15559 1/20 0.43
CA1 P00915 5/20 0.42
CA2 P00918 5/20 0.42
CA12 O43570 3/20 0.42
CA9 Q16790 3/20 0.42
CA3 P07451 2/20 0.42
CA4 P22748 2/20 0.42
CA6 P23280 2/20 0.42
CA5A P35218 2/20 0.42
CA7 P43166 2/20 0.42
CA13 Q8N1Q1 2/20 0.42
CA14 Q9ULX7 2/20 0.42

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
SCHEMBL30947813 1.00 KMT2A (1.00) KMT2AMEN1LMNAALPGMAPK1
SCHEMBL29950811 0.81 MEN1 (0.68) KMT2AMEN1LMNAALPGMAPK1
SCHEMBL29954496 0.81 ALPG (1.00) KMT2AMEN1LMNAALPGMAPK1
SCHEMBL11360521 0.81 MEN1 (0.68) KMT2AMEN1LMNAALPGMAPK1
SCHEMBL29951128 0.81 KMT2A (0.68) KMT2AMEN1LMNAALPGMAPK1
SCHEMBL11377296 0.78 MAPK1 (1.00) KMT2AMEN1LMNAALPGMAPK1
SCHEMBL29096713 0.78 ALPG (0.68) KMT2AMEN1LMNAALPGMAPK1
SCHEMBL10823592 0.78 ALPG (0.68) KMT2AMEN1LMNAALPGMAPK1
SCHEMBL29956169 0.78 ALPG (0.68) KMT2AMEN1LMNAALPGMAPK1
SCHEMBL29956168 0.78 MAPK1 (1.00) KMT2AMEN1LMNAALPGMAPK1

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