SCHEMBL19823535

SCHEMBL19823535

CC(C)c1ccc(Oc2ccc(N3C(=O)c4ccc(C(c5ccc6c(c5)C(=O)N(C)C6=O)(C(F)(F)F)C(F)(F)F)cc4C3=O)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.40
▸ PKM P14618 1/20 0.39
▸ CA9 Q16790 3/20 0.39
▸ CA12 O43570 2/20 0.39
▸ CA1 P00915 2/20 0.39
▸ ESR1 P03372 1/20 0.39
▸ CA2 P00918 1/20 0.38
▸ KMT2A Q03164 5/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ NPBWR1 P48145 1/20 0.37
▸ MCHR1 Q99705 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ MEN1 O00255 4/20 0.37
▸ HTT P42858 1/20 0.36
▸ POLB P06746 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ MGLL Q99685 1/20 0.35
▸ MAPT P10636 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34

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
SCHEMBL30829232 0.89 MEN1 (0.47) BRD4PKMCA9CA12CA1
SCHEMBL1962793 0.89 MEN1 (0.47) BRD4PKMCA9CA12CA1
SCHEMBL1104522 0.88 MEN1 (0.46) BRD4PKMCA9CA12CA1
SCHEMBL21973674 0.88 BRD4 (0.47) BRD4PKMCA9CA12CA1
SCHEMBL14106915 0.87 BRD4 (0.50) BRD4PKMCA9CA12CA1
SCHEMBL12009338 0.85 MEN1 (0.44) BRD4PKMCA9CA12CA1
SCHEMBL25969185 0.84 MEN1 (0.52) BRD4PKMCA9CA12CA1
SCHEMBL25969188 0.84 MEN1 (0.52) BRD4PKMCA9CA12CA1
SCHEMBL15744784 0.83 BRD4 (0.48) BRD4PKMCA9CA12CA1
SCHEMBL9720149 0.83 ALDH1A1 (0.48) BRD4PKMCA9CA12CA1

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-3275969-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, LUMINESCENT MATERIAL, AND ORGANIC ELECTROLUMINESCENCE ELEMENT Hodogaya Chemical Co., Ltd. (JP) 2018-01-31 — — EP disclosed
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