SCHEMBL14438540

SCHEMBL14438540

Cc1ccc2c(c1)C(=O)N(Cc1ccc(Oc3cccc(Oc4ccc(N5C(=O)c6ccc(C#Cc7ccccc7)cc6C5=O)cc4)c3)cc1)C2=O

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
BRD4 O60885 1/20 0.46
LPAR1 Q92633 1/20 0.43
LPAR3 Q9UBY5 1/20 0.43
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA9 Q16790 2/20 0.42
CA2 P00918 1/20 0.42
GRM5 P41594 3/20 0.42
MCHR1 Q99705 1/20 0.40
HTT P42858 1/20 0.40
NR1H2 P55055 1/20 0.39
NR1H3 Q13133 1/20 0.39
POLB P06746 2/20 0.39
PTGES O14684 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL10000443 0.92 MEN1 (0.56) MEN1KMT2ABRD4LPAR1LPAR3
SCHEMBL84247 0.89 MEN1 (0.58) MEN1KMT2ABRD4LPAR1LPAR3
SCHEMBL14452379 0.82 MEN1 (0.45) MEN1KMT2ABRD4LPAR1LPAR3
SCHEMBL10000448 0.82 BRD4 (0.55) MEN1KMT2ABRD4CA1CA9
SCHEMBL6400602 0.82 BRD4 (0.56) MEN1KMT2ABRD4LPAR1LPAR3
SCHEMBL19689371 0.81 BRD4 (0.58) MEN1KMT2ABRD4LPAR1LPAR3
SCHEMBL15695540 0.81 BRD4 (0.56) MEN1KMT2ABRD4GRM5MCHR1
SCHEMBL14259658 0.80 MEN1 (0.50) MEN1KMT2ABRD4LPAR1LPAR3
SCHEMBL12908006 0.80 MEN1 (0.49) MEN1KMT2ABRD4LPAR1LPAR3
SCHEMBL12908009 0.80 MEN1 (0.49) MEN1KMT2ABRD4LPAR1LPAR3

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-20070195682-A1 METHOD FOR HIGH DENSITY DATA STORAGE AND IMAGING GLOBALFOUNDRIES INC. (KY) 2007-08-23 US disclosed