SCHEMBL20081072

SCHEMBL20081072

CC(=O)c1ccc(Oc2ccc3c(c2)C(=O)N(c2ccc(Oc4ccccc4)cc2)C3=O)cc1C(C)=O

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.60
▸ KMT2A Q03164 5/20 0.53
▸ MEN1 O00255 4/20 0.53
▸ HTT P42858 1/20 0.53
▸ POLB P06746 3/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ PKM P14618 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ PTGES O14684 1/20 0.50
▸ GAA P10253 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ LPAR1 Q92633 2/20 0.47
▸ LPAR3 Q9UBY5 2/20 0.47
▸ LPAR5 Q9H1C0 1/20 0.47
▸ MCHR1 Q99705 1/20 0.47
▸ ESR1 P03372 1/20 0.46
▸ CA1 P00915 1/20 0.46
▸ CA9 Q16790 1/20 0.46

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
SCHEMBL17272758 0.85 BRD4 (0.73) BRD4KMT2AMEN1HTTPOLB
SCHEMBL19322288 0.84 PTGES (0.61) BRD4KMT2AMEN1POLBMAPK1
SCHEMBL20081123 0.82 BRD4 (0.86) BRD4KMT2AMEN1HTTPOLB
SCHEMBL261725 0.80 BRD4 (0.68) BRD4KMT2AMEN1HTTPOLB
SCHEMBL13678848 0.79 MEN1 (0.69) BRD4KMT2AMEN1HTTPOLB
SCHEMBL19689370 0.79 BRD4 (0.72) BRD4KMT2AMEN1HTTPOLB
SCHEMBL12289346 0.79 MAPK1 (0.48) BRD4KMT2AMEN1HTTPOLB
SCHEMBL20512982 0.79 POLB (0.63) BRD4KMT2AMEN1POLBMAPK1
SCHEMBL17281694 0.78 PTGES (0.64) BRD4KMT2AMEN1POLBMAPK1
SCHEMBL10000442 0.78 BRD4 (0.74) BRD4KMT2AMEN1HTTPOLB

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
EP-3145974-B1 METHOD FOR MAKING PARTICULATE AMINE-FUNCTIONALIZED POLYARYLETHERKETONE POLYMERS AND COPOLYMERS THEREOF KETONEX LTD (GB) 2018-04-25 — — EP disclosed
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