SCHEMBL20164239

SCHEMBL20164239

CCCc1ccc(C(=O)Oc2c(C)cc(C(C)(C)C)cc2N(C(=O)OCC)c2ccccc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.35
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
MAPT P10636 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KMT2A Q03164 5/20 0.34
ALDH1A1 P00352 4/20 0.34
MEN1 O00255 3/20 0.34
LMNA P02545 1/20 0.34
PTPN1 P18031 1/20 0.33
NR1H4 Q96RI1 1/20 0.33
NOD2 Q9HC29 1/20 0.33
ABCB1 P08183 1/20 0.33
RAB9A P51151 2/20 0.33
ESRRG P62508 1/20 0.33
NPC1 O15118 1/20 0.33
GAA P10253 1/20 0.32
ALOX12 P18054 1/20 0.32

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
SCHEMBL20164206 0.91 MAPT (0.42) NPSR1SMN1; SMN2MAPTTDP1L3MBTL1
SCHEMBL20164267 0.89 TP53 (0.38) NPSR1SMN1; SMN2MAPTTDP1L3MBTL1
SCHEMBL20164240 0.87 NR1H4 (0.39) NPSR1SMN1; SMN2MAPTTDP1L3MBTL1
SCHEMBL20164228 0.85 ABCB1 (0.35) NPSR1SMN1; SMN2MAPTL3MBTL1KMT2A
SCHEMBL20164300 0.85 ABCB1 (0.38) NPSR1SMN1; SMN2MAPTL3MBTL1KMT2A
SCHEMBL16556137 0.85 NPSR1 (0.41) NPSR1SMN1; SMN2ESR1ESR2MAPT
SCHEMBL16556228 0.83 NPSR1 (0.42) NPSR1ESR1ESR2MAPTTDP1
SCHEMBL20164245 0.83 LMNA (0.43) NPSR1SMN1; SMN2MAPTTDP1L3MBTL1
SCHEMBL20164256 0.82 ABCB1 (0.35) NPSR1SMN1; SMN2MAPTL3MBTL1KMT2A
SCHEMBL20164273 0.80 MAPT (0.43) NPSR1SMN1; SMN2MAPTTDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3298048-B1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA SRL (IT) 2019-07-03 EP disclosed
US-10221256-B2 Catalyst components for the polymerization of olefins BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2019-03-05 US disclosed
US-20180142044-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2018-05-24 US disclosed