SCHEMBL28065839

SCHEMBL28065839

Cc1cc(OC(=O)c2ccccc2)cc(C(C)(C)C)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.65
MAPT P10636 3/20 0.65
L3MBTL1 Q9Y468 1/20 0.65
KMT2A Q03164 6/20 0.47
MEN1 O00255 2/20 0.47
RXRA P19793 1/20 0.47
RXRB P28702 1/20 0.47
ALDH1A1 P00352 4/20 0.46
THRB P10828 1/20 0.46
PKM P14618 1/20 0.45
PARP10 Q53GL7 1/20 0.44
TNF P01375 1/20 0.43
KLF5 Q13887 1/20 0.43
NOD1 Q9Y239 1/20 0.43
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
KDM4E B2RXH2 1/20 0.42
GLA P06280 1/20 0.42
GAA P10253 1/20 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
SCHEMBL9339411 0.85 KMT2A (0.58) TDP1MAPTL3MBTL1KMT2AMEN1
SCHEMBL28852306 0.85 KMT2A (0.58) TDP1MAPTL3MBTL1KMT2AMEN1
SCHEMBL17376972 0.83 MAPT (0.53) TDP1MAPTL3MBTL1KMT2AMEN1
SCHEMBL13110206 0.81 MAPT (0.69) TDP1MAPTL3MBTL1KMT2AMEN1
SCHEMBL547102 0.80 TDP1 (0.61) TDP1MAPTL3MBTL1KMT2AMEN1
SCHEMBL7368072 0.80 TPMT (0.52) TDP1MAPTL3MBTL1KMT2AMEN1
SCHEMBL8210174 0.79 MAPT (1.00) TDP1MAPTL3MBTL1KMT2AMEN1
SCHEMBL27645399 0.78 KMT2A (0.50) TDP1MAPTL3MBTL1KMT2AMEN1
SCHEMBL9338150 0.78 MAPT (0.68) TDP1MAPTL3MBTL1KMT2AMEN1
SCHEMBL11422565 0.77 TDP1 (0.58) TDP1MAPTL3MBTL1KMT2AMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104540855-B Catalyst components for the polymerization of olefins 巴塞尔聚烯烃意大利有限公司 2016-08-31 CN disclosed
CN-104540855-A Catalyst components for the polymerization of olefins BASELL POLIOLEFINE SPA 2015-04-22 CN disclosed