SCHEMBL29006702

SCHEMBL29006702

Cc1cccc(C)c1OP(=O)(c1ccccc1)c1cc(O)c2ccccc2c1O

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.44
LMNA P02545 2/20 0.44
THRB P10828 1/20 0.41
MAPT P10636 5/20 0.40
KMT2A Q03164 5/20 0.40
MEN1 O00255 4/20 0.40
POLB P06746 4/20 0.40
KDM4E B2RXH2 3/20 0.40
NSD2 O96028 1/20 0.40
MCL1 Q07820 1/20 0.40
GAA P10253 3/20 0.40
TP53 P04637 2/20 0.40
HSD17B10 Q99714 1/20 0.40
ESR1 P03372 2/20 0.36
ESR2 Q92731 2/20 0.36
PKM P14618 1/20 0.36
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL4864990 0.80 MAPT (0.39) HTTLMNAMAPTKMT2AMEN1
SCHEMBL4865359 0.76 ESR2 (0.42) HTTLMNAMAPTKMT2AMEN1
SCHEMBL28657683 0.73 PDE4B (0.37) HTTLMNATHRBMAPTKMT2A
SCHEMBL28973790 0.73 PTPN22 (0.35) MAPTKMT2AMEN1KDM4EGAA
SCHEMBL28652422 0.72 THRB (0.50) HTTLMNATHRBMAPTKMT2A
SCHEMBL28642825 0.71 BACE1 (0.44) HTTLMNATHRBMAPTKMT2A
Methyl Alcohol SCHEMBL28451997 0.69 L3MBTL1 (0.42) HTTLMNAMAPTKMT2AMEN1
SCHEMBL4138765 0.69 CA2 (0.45) LMNAMAPTKMT2APOLBKDM4E
SCHEMBL28367173 0.69 L3MBTL1 (0.44) HTTLMNAKMT2AMEN1NPSR1
SCHEMBL30293801 0.68 HTT (0.44) HTTLMNATHRBMAPTKMT2A

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
CN-115806653-A Naphthalene-series halogen-free flame-retardant epoxy resin and preparation method and application thereof 江苏扬农锦湖化工有限公司 2023-03-17 CN disclosed