SCHEMBL3783723

SCHEMBL3783723

CC(C)(C)OC(=O)Nc1ccccc1-c1ccccc1N

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD9 Q9H8M2 1/20 0.47
HSP90AA1 P07900 1/20 0.45
HSP90AB1 P08238 1/20 0.45
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
RXFP1 Q9HBX9 1/20 0.43
HDAC1 Q13547 3/20 0.43
IDO1 P14902 2/20 0.41
METAP1 P53582 1/20 0.41
TRPV1 Q8NER1 1/20 0.41
BRD4 O60885 1/20 0.40
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HDAC3 O15379 2/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
NCOR2 Q9Y618 1/20 0.39
RAB9A P51151 1/20 0.39
SMARCA2 P51531 1/20 0.39

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
SCHEMBL3789289 0.90 BRD9 (0.45) BRD9HSP90AA1HSP90AB1LMNAPOLB
SCHEMBL3788603 0.88 HSP90AA1 (0.46) BRD9HSP90AA1HSP90AB1LMNAPOLB
SCHEMBL3791007 0.88 BRD9 (0.43) BRD9HSP90AA1HSP90AB1LMNAPOLB
SCHEMBL3784001 0.88 BRD9 (0.43) BRD9HSP90AA1HSP90AB1LMNAPOLB
SCHEMBL211033 0.87 HDAC1 (0.52) BRD9LMNAPOLBRXFP1HDAC1
SCHEMBL29353000 0.87 HDAC1 (0.52) BRD9LMNAPOLBRXFP1HDAC1
SCHEMBL25066473 0.84 HDAC3 (0.45) LMNAHDAC1ALDH1A1L3MBTL1HDAC3
SCHEMBL3787700 0.84 ATR (0.39) BRD9HSP90AA1HSP90AB1LMNAPOLB
SCHEMBL4414634 0.83 LMNA (0.48) BRD9HSP90AA1HSP90AB1LMNAPOLB
SCHEMBL1172444 0.83 RXFP1 (0.44) BRD9HSP90AA1HSP90AB1LMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2174928-B1 TRANSITION METAL COMPLEX COMPOUND, OLEFIN OLIGOMERIZATION CATALYST CONTAINING THE COMPOUND, AND METHOD FOR PRODUCING OLEFIN OLIGOMER PERFORMED IN THE PRESENCE OF THE CATALYST MITSUI CHEMICALS INC (JP) 2015-03-11 EP disclosed
US-8258361-B2 Transition metal complex compounds, olefin oligomerization catalysts including the compounds, and processes for producing olefin oligomers using the catalysts MITSUI CHEMICALS, INC. (JP) 2012-09-04 US disclosed
US-8258361-B2 Transition metal complex compounds, olefin oligomerization catalysts including the compounds, and processes for producing olefin oligomers using the catalysts MITSUI CHEMICALS, INC. (JP) 2012-09-04 US disclosed
US-20110082325-A1 TRANSITION METAL COMPLEX COMPOUNDS, OLEFIN OLIGOMERIZATION CATALYSTS INCLUDING THE COMPOUNDS, AND PROCESSES FOR PRODUCING OLEFIN OLIGOMERS USING THE CATALYSTS MITSUI CHEMICALS, INC. 2011-04-07 US disclosed
US-20110082325-A1 TRANSITION METAL COMPLEX COMPOUNDS, OLEFIN OLIGOMERIZATION CATALYSTS INCLUDING THE COMPOUNDS, AND PROCESSES FOR PRODUCING OLEFIN OLIGOMERS USING THE CATALYSTS MITSUI CHEMICALS, INC. 2011-04-07 US disclosed
EP-2174928-A1 TRANSITION METAL COMPLEX COMPOUND, OLEFIN POLYMERIZATION CATALYST CONTAINING THE COMPOUND, AND METHOD FOR PRODUCING OLEFIN POLYMER PERFORMED IN THE PRESENCE OF THE CATALYST Mitsui Chemicals, Inc. (JP) 2010-04-14 EP disclosed
US-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 US disclosed
EP-1914221-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-04-23 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110082325-A1 TRANSITION METAL COMPLEX COMPOUNDS, OLEFIN OLIGOMERIZATION CATALYSTS INCLUDING THE COMPOUNDS, AND PROCESSES FOR PRODUCING OLEFIN OLIGOMERS USING THE CATALYSTS OSTC, COG4, COG7 BRD9 3554/4885HSP90AA1 3853/4885HSP90AB1 3782/4885
US-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND NISCH, BLVRB, BBOX1 BRD9 247/4885HSP90AA1 4759/4885HSP90AB1 4609/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.