SCHEMBL20164236

SCHEMBL20164236

CCOC(=O)N(C)c1cc(C(C)(C)C)cc(C)c1OC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
TSHR P16473 2/20 0.36
HTT P42858 2/20 0.34
RAB9A P51151 2/20 0.34
KDM4E B2RXH2 2/20 0.34
TP53 P04637 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
HSD17B10 Q99714 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
ELANE P08246 1/20 0.31
CD69 Q07108 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL20164250 0.88 TSHR (0.38) LMNATSHRRAB9AHPGDKMT2A
SCHEMBL20164209 0.86 TSHR (0.38) LMNATSHRHTTRAB9AKDM4E
SCHEMBL18249390 0.85 KDM4E (0.36) LMNATSHRHTTKDM4ETP53
SCHEMBL20164281 0.83 TDP1 (0.44) LMNARAB9AKDM4EGAAMAPT
SCHEMBL20164286 0.81 GAA (0.38) LMNATSHRRAB9ATP53GAA
SCHEMBL20164235 0.81 LMNA (0.43) LMNATSHRHTTRAB9AKDM4E
SCHEMBL20164228 0.80 ABCB1 (0.35) LMNATSHRRAB9ATP53MAPT
SCHEMBL20164284 0.79 LMNA (0.41) LMNARAB9AKDM4ETP53GAA
SCHEMBL18249436 0.77 KDM4E (0.48) LMNATSHRHTTRAB9AKDM4E
SCHEMBL18249466 0.76 ELANE (0.39) LMNATSHRKDM4EMAPTKMT2A

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