SCHEMBL19084338

SCHEMBL19084338

CCOc1ccc(C(=O)Oc2cccc3cccc(OC(=O)c4ccc(OCC)cc4)c23)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNC P24863 2/20 0.53
CDK8 P49336 2/20 0.53
KMT2A Q03164 4/20 0.51
PDGFRB P09619 1/20 0.49
PDGFRA P16234 1/20 0.49
PARP10 Q53GL7 1/20 0.49
LMNA P02545 3/20 0.48
MAPT P10636 5/20 0.47
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.46
PLK1 P53350 1/20 0.46
THRB P10828 1/20 0.46
SCN1A P35498 1/20 0.46
SCN2A Q99250 1/20 0.46
SCN3A Q9NY46 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TP53 P04637 1/20 0.46
KDM4E B2RXH2 1/20 0.46
HTT P42858 1/20 0.46
CCR6 P51684 1/20 0.46

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
SCHEMBL19085330 0.96 MAPT (0.52) CCNCCDK8KMT2APDGFRBPDGFRA
SCHEMBL19085372 0.95 CCNC (0.49) CCNCCDK8KMT2APDGFRBPDGFRA
SCHEMBL19281449 0.86 CCNC (0.60) CCNCCDK8KMT2APDGFRBPDGFRA
SCHEMBL19084337 0.83 ESR1 (0.62) KMT2APDGFRBPDGFRALMNAMAPT
SCHEMBL31321713 0.81 HPGD (0.58) CCNCCDK8KMT2APARP10LMNA
SCHEMBL20646378 0.80 ESR1 (0.60) KMT2ALMNAALDH1A1
SCHEMBL5706089 0.79 L3MBTL1 (0.55) CCNCCDK8KMT2APDGFRBPDGFRA
SCHEMBL22154468 0.79 MAPT (0.42) KMT2ALMNAMAPTMEN1NPC1
SCHEMBL19642827 0.79 CCNC (0.50) CCNCCDK8KMT2APARP10LMNA
SCHEMBL9905987 0.79 KMT2A (0.73) CCNCCDK8KMT2APARP10LMNA

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
WO-2017117443-A1 NON-PHTHALATE CATALYST SYSTEM AND ITS USE IN THE POLYMERIZATION OF OLEFINS BRASKEM AMERICA, INC. (US) 2017-07-06 WO disclosed
WO-2017117439-A1 NON-PHTHALATE CATALYST SYSTEM AND ITS USE IN THE POLYMERIZATION OF OLEFINS BRASKEM AMERICA, INC. (US) 2017-07-06 WO disclosed
WO-2017117433-A1 NON-PHTHALATE CATALYST SYSTEM AND ITS USE IN THE POLYMERIZATION OF OLEFINS BRASKEM AMERICA, INC. (US) 2017-07-06 WO disclosed