SCHEMBL1273451

SCHEMBL1273451

CN1[C]N(c2cnccn2)c2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.43
LMNA P02545 1/20 0.43
P4HTM Q9NXG6 1/20 0.34
KDM4E B2RXH2 2/20 0.34
TP53 P04637 1/20 0.34
RXFP1 Q9HBX9 1/20 0.33
THRB P10828 1/20 0.33
CYP17A1 P05093 2/20 0.33
CYP1A2 P05177 2/20 0.33
SLC6A7 Q99884 1/20 0.32
OPRM1 P35372 3/20 0.32
SCN9A Q15858 1/20 0.32
EGLN2 Q96KS0 1/20 0.32
POLB P06746 1/20 0.31
ALOX15 P16050 1/20 0.31
NR4A1 P22736 1/20 0.31
KCNH2 Q12809 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
OPRL1 P41146 1/20 0.31

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
SCHEMBL1274000 0.81 SMN1; SMN2 (0.41) KDM4EEGLN2POLB
SCHEMBL1273999 0.81 SMN1; SMN2 (0.41) KDM4EEGLN2POLB
SCHEMBL20062935 0.68 L3MBTL1 (0.46) L3MBTL1LMNAP4HTMKDM4ETP53
SCHEMBL12929419 0.68 L3MBTL1 (0.47) L3MBTL1LMNAKDM4ETP53THRB
SCHEMBL851762 0.67 MAOA (0.40) L3MBTL1LMNAKDM4ETP53
SCHEMBL851761 0.67 MAOA (0.40) L3MBTL1LMNAKDM4ETP53
SCHEMBL20072041 0.67 L3MBTL1 (0.45) L3MBTL1LMNAP4HTMKDM4ETP53
SCHEMBL17335801 0.61 ROCK1 (0.57) L3MBTL1LMNATP53RXFP1SCN9A
SCHEMBL14799995 0.61 KDM4E (0.43) L3MBTL1LMNAP4HTMKDM4ECYP17A1
SCHEMBL27796280 0.60 LMNA (0.40) L3MBTL1LMNAP4HTMKDM4ESLC6A7

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
US-9359680-B2 Ruthenium or osmium complexes and their uses as catalysts for water oxidation THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2016-06-07 US disclosed
WO-2016028738-A1 STABILIZATION OF CHROMOPHORES OR CATALYSTS WITH POLYMER OVERLAYERS THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2016-02-25 WO disclosed
US-20150073143-A1 Ruthenium or Osmium Complexes and Their Uses as Catalysts for Water Oxidation THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2015-03-12 US disclosed
US-8871078-B2 Ruthenium or osmium complexes and their uses as catalysts for water oxidation THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2014-10-28 US disclosed
US-20140034505-A1 Ruthenium or Osmium Complexes and Their Uses as Catalysts for Water Oxidation THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2014-02-06 US disclosed
US-8524903-B2 Ruthenium or osmium complexes and their uses as catalysts for water oxidation THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2013-09-03 US disclosed
US-20110042227-A1 Ruthenium or Osmium Complexes and Their Uses as Catalysts for Water Oxidation THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2011-02-24 US 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-20150073143-A1 Ruthenium or Osmium Complexes and Their Uses as Catalysts for Water Oxidation PPOX, AQP1, AQP3 L3MBTL1 4502/4885LMNA 4616/4885P4HTM 2034/4885
US-20110042227-A1 Ruthenium or Osmium Complexes and Their Uses as Catalysts for Water Oxidation PPOX, AQP1, AQP3 L3MBTL1 4502/4885LMNA 4616/4885P4HTM 2034/4885

“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.