SCHEMBL15427941

SCHEMBL15427941

CC(C)(C)c1cc(O)c2nc3c4cccnc4c4c(n3c2c1)C(C)(C)CC4(C)C

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
UQCRB P14927 1/20 0.33
KDM4E B2RXH2 2/20 0.32
HTT P42858 2/20 0.32
MPI P34949 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32
IDO1 P14902 1/20 0.32
PSMB5 P28074 1/20 0.32
SLC6A2 P23975 1/20 0.32
COMT P21964 1/20 0.31
NPC1 O15118 1/20 0.31
ALOX12 P18054 1/20 0.31
RAB9A P51151 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL15428314 0.88
SCHEMBL15427715 0.88
SCHEMBL15427721 0.85 PDE2A (0.34) UQCRB
SCHEMBL19670904 0.82
SCHEMBL17084987 0.79
SCHEMBL15427943 0.76 CCR1 (0.35) KDM4EHTTL3MBTL1HSP90AA1SLC6A2
SCHEMBL15427720 0.76
SCHEMBL15840884 0.67 PGR (0.41) KDM4ENPSR1
SCHEMBL13225624 0.66 KDM4E (0.53) KDM4EHTTL3MBTL1COMTNPC1
SCHEMBL15428249 0.60 KDM4E (0.36) KDM4EHTTNPC1RAB9ANPSR1

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-9837622-B2 Metal complexes MERCK PATENT GMBH (DE) 2017-12-05 US disclosed
US-9837622-B2 Metal complexes MERCK PATENT GMBH (DE) 2017-12-05 US disclosed
US-20150263297-A1 Metal Complexes MERCK PATENT GMBH (DE) 2015-09-17 US disclosed
US-20150263297-A1 Metal Complexes MERCK PATENT GMBH (DE) 2015-09-17 US disclosed
WO-2014008982-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2014-01-16 WO 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-20150263297-A1 Metal Complexes SOD1, AP1M1, AP3M1 UQCRB 162/4885KDM4E 3816/4885HTT 1979/4885

“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.