SCHEMBL19656164

SCHEMBL19656164

O=C(/C=C/c1ccccc1F)Oc1cccc2cccc(OC(=O)/C=C/c3ccccc3F)c12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.48
CYP1B1 Q16678 2/20 0.45
CYP1A1 P04798 1/20 0.45
MAOB P27338 3/20 0.44
RAB9A P51151 4/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
MAPT P10636 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
LMNA P02545 2/20 0.44
NPC1 O15118 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
NFE2L2 Q16236 3/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
RECQL P46063 1/20 0.42
HPGD P15428 1/20 0.41

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
SCHEMBL29563649 1.00 KDM4E (0.48) KDM4EALDH1A1CYP1B1CYP1A1MAOB
SCHEMBL19642828 0.91 MAPT (0.47) KDM4EALDH1A1CYP1B1CYP1A1MAOB
SCHEMBL19642829 0.91 MAPT (0.47) KDM4EALDH1A1CYP1B1CYP1A1MAOB
SCHEMBL19643102 0.87 NTSR1 (0.58) KDM4EALDH1A1RAB9AMEN1KMT2A
SCHEMBL19643101 0.87 NTSR1 (0.58) KDM4EALDH1A1RAB9AMEN1KMT2A
SCHEMBL19656167 0.83 KDM4E (0.51) KDM4EALDH1A1MAOBRAB9AMEN1
SCHEMBL29563470 0.83 KDM4E (0.51) KDM4EALDH1A1MAOBRAB9AMEN1
SCHEMBL28706756 0.82 KDM4E (0.38) KDM4EALDH1A1CYP1B1CYP1A1MAOB
SCHEMBL21314853 0.82 ALDH1A1 (0.43) KDM4EALDH1A1CYP1B1CYP1A1MAOB
SCHEMBL19656162 0.79 KMT2A (0.52) KDM4EALDH1A1CYP1B1MAOBRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11370854-B2 Non-phthalate donor for polyolefin catalysts BRASKEM AMERICA, INC. (US) 2022-06-28 US disclosed
US-20200223958-A1 NON-PHTHALATE DONOR FOR POLYOLEFIN CATALYSTS W.R. GRACE & CO.-CONN. (US) 2020-07-16 US disclosed
US-10662267-B2 Non-phthalate donor for polyolefin catalysts W.R. GRACE & CO. -CONN. (US) 2020-05-26 US disclosed
US-20190270831-A1 NON-PHTHALATE DONOR FOR POLYOLEFIN CATALYSTS W. R. GRACE & CO. - CONN. 2019-09-05 US disclosed
WO-2017204811-A1 NON-PHTHALATE DONOR FOR POLYOLEFIN CATALYSTS W.R. GRACE & CO. -CONN. (US) 2017-11-30 WO disclosed