SCHEMBL1685293

SCHEMBL1685293

COc1ccccc1-c1cccc2cccc(N)c12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.53
ADRA2B P18089 1/20 0.53
PTGS1 P23219 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
KDM4E B2RXH2 4/20 0.46
GAA P10253 3/20 0.46
MAPT P10636 3/20 0.46
HPGD P15428 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
JAK2 O60674 1/20 0.44
HSP90AA1 P07900 2/20 0.44
MAPK1 P28482 2/20 0.43
HSD17B10 Q99714 2/20 0.43
TSHR P16473 1/20 0.43
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
RECQL P46063 1/20 0.43
ADORA2A P29274 2/20 0.43

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
SCHEMBL24384353 0.91 ALDH1A1 (0.50) ALDH1A1ADRA2BPTGS1TDP1MEN1
SCHEMBL1685303 0.86 ALDH1A1 (0.53) ALDH1A1ADRA2BPTGS1TDP1MEN1
SCHEMBL32674283 0.83 ALDH1A1 (0.58) ALDH1A1ADRA2BPTGS1TDP1MEN1
SCHEMBL1803794 0.83 ALDH1A1 (0.58) ALDH1A1ADRA2BPTGS1TDP1MEN1
SCHEMBL395260 0.81 ALDH1A1 (0.67) ALDH1A1ADRA2BPTGS1TDP1MEN1
SCHEMBL1922106 0.79 ALDH1A1 (0.59) ALDH1A1ADRA2BPTGS1TDP1MEN1
SCHEMBL21886372 0.79 KDM4E (0.47) ALDH1A1TDP1MEN1KMT2AKDM4E
SCHEMBL13724253 0.78 ALDH1A1 (0.57) ALDH1A1ADRA2BPTGS1TDP1MEN1
SCHEMBL21886373 0.77 MEN1 (0.49) ALDH1A1MEN1KMT2AKDM4EGAA
SCHEMBL301996 0.76 CA1 (0.71) ALDH1A1ADRA2BPTGS1TDP1MEN1

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 4 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-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

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

For each of this compound's patents that has machine-readable text (1 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 ALDH1A1 2282/4885ADRA2B 4317/4885PTGS1 1355/4885

“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.