SCHEMBL15841338

SCHEMBL15841338

O=C1C=CC(=O)N1c1ccccc1.[Ru]

nearest known ligand 0.95

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 15/20 0.95
FAAH O00519 8/20 0.71
HSP90AA1 P07900 4/20 0.63
PKM P14618 2/20 0.63
ALDH1A1 P00352 1/20 0.63
HTT P42858 1/20 0.63
ATM Q13315 1/20 0.63
TLR9 Q9NR96 1/20 0.56
BCHE P06276 1/20 0.56
MAPK1 P28482 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
DDAH1 O94760 1/20 0.56

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
SCHEMBL18713 0.97 MGLL (1.00) MGLLFAAHHSP90AA1PKMALDH1A1
SCHEMBL8920586 0.97 MGLL (1.00) MGLLFAAHHSP90AA1PKMALDH1A1
Benzene SCHEMBL28088808 0.97 MGLL (1.00) MGLLFAAHHSP90AA1PKMALDH1A1
SCHEMBL30657178 0.95 MGLL (0.95) MGLLFAAHHSP90AA1PKMALDH1A1
Methane SCHEMBL28268601 0.95 MGLL (0.95) MGLLFAAHHSP90AA1PKMALDH1A1
Hydrochloric Acid SCHEMBL8536567 0.95 MGLL (0.95) MGLLFAAHHSP90AA1PKMALDH1A1
Arsenic SCHEMBL28143838 0.95 MGLL (0.95) MGLLFAAHHSP90AA1PKMALDH1A1
Ammonia Solution, Strong SCHEMBL28183953 0.95 MGLL (0.95) MGLLFAAHHSP90AA1PKMALDH1A1
Formaldehyde SCHEMBL27804450 0.92 MGLL (0.90) MGLLFAAHHSP90AA1PKMALDH1A1
Cyanide SCHEMBL27588214 0.92 MGLL (0.90) MGLLFAAHHSP90AA1PKMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2749579-B1 CONJUGATED DIENE POLYMER AND METHOD FOR PRODUCING SAME ZEON CORP (JP) 2017-11-15 EP disclosed
US-9745394-B2 Conjugated diene polymer and method for producing same ZEON CORPORATION (JP) 2017-08-29 US disclosed
EP-3026069-A1 RUTHENIUM COMPLEX Zeon Corporation (JP) 2016-06-01 EP disclosed
US-20160096910-A1 CONJUGATED DIENE POLYMER AND METHOD FOR PRODUCING SAME ZEON CORPORATION (JP) 2016-04-07 US disclosed
US-9243100-B2 Conjugated diene polymer and method for producing same ZEON CORPORATION (JP) 2016-01-26 US disclosed
US-20140350201-A1 CONJUGATED DIENE POLYMER AND METHOD FOR PRODUCING SAME KYOTO UNIVERSITY (JP) 2014-11-27 US disclosed
EP-2749579-A1 CONJUGATED DIENE POLYMER AND METHOD FOR PRODUCING SAME Zeon Corporation (JP) 2014-07-02 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-20160096910-A1 CONJUGATED DIENE POLYMER AND METHOD FOR PRODUCING SAME PCNA, TELO2, MSN MGLL 1027/4885FAAH 2438/4885HSP90AA1 3371/4885

“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.