SCHEMBL20164262

SCHEMBL20164262

CCCc1ccc(C(=O)Oc2cccc3cccc(N(C)C(=O)OCC)c23)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR2F2 P24468 1/20 0.36
PAX8 Q06710 1/20 0.36
KLF5 Q13887 1/20 0.36
MAPT P10636 5/20 0.36
NPC1 O15118 4/20 0.36
RAB9A P51151 4/20 0.36
ALDH1A1 P00352 3/20 0.36
KMT2A Q03164 2/20 0.36
THRB P10828 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 2/20 0.35
USP2 O75604 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
NCEH1 Q6PIU2 3/20 0.35
PRSS1 P07477 2/20 0.35
ACR P10323 2/20 0.35

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
SCHEMBL20164244 0.89 SMN1; SMN2 (0.41) NR2F2PAX8KLF5MAPTNPC1
SCHEMBL18249412 0.83 MAPT (0.37) NR2F2PAX8KLF5MAPTNPC1
SCHEMBL15233893 0.82 TYMS (0.41) NR2F2PAX8KLF5MAPTNPC1
SCHEMBL20164291 0.80 NCEH1 (0.42) NR2F2PAX8KLF5MAPTNPC1
SCHEMBL20164266 0.79 SMN1; SMN2 (0.41) NR2F2PAX8KLF5MAPTNPC1
SCHEMBL16239134 0.78 THRB (0.38) NR2F2PAX8KLF5MAPTNPC1
SCHEMBL18249413 0.77 KMT2A (0.46) MAPTNPC1RAB9AALDH1A1KMT2A
SCHEMBL20164204 0.76 NPSR1 (0.39) MAPTNPC1RAB9AALDH1A1KMT2A
SCHEMBL15233917 0.76 PLK1 (0.41) ALDH1A1THRBSMN1; SMN2HSD17B10PLK1
SCHEMBL18249415 0.76 ABCB1 (0.37) MAPTNPC1RAB9AALDH1A1KMT2A

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