SCHEMBL12034274

SCHEMBL12034274

CCCn1nc(N=NC2=C(O)OC(C)(C)OC2=O)cc1C

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.32
▸ ADORA2A P29274 1/20 0.30
▸ ADORA2B P29275 1/20 0.30

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
SCHEMBL12034282 0.77 EPHX2 (0.33) EPHX2ADORA2AADORA2B
SCHEMBL12034279 0.68 SMN1; SMN2 (0.33) —
SCHEMBL15133250 0.68 MAPT (0.43) EPHX2ADORA2AADORA2B
SCHEMBL15134091 0.68 MAPT (0.43) EPHX2ADORA2AADORA2B
SCHEMBL13661843 0.66 CA12 (0.37) —
SCHEMBL12034202 0.66 LMNA (0.35) ADORA2AADORA2B
SCHEMBL13661831 0.65 MAPT (0.45) —
SCHEMBL15132829 0.65 LMNA (0.30) —
SCHEMBL13661787 0.64 — —
SCHEMBL14373798 0.62 ESR1 (0.34) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8309196-B2 Optical recording medium, optical recording material and metal complex compound MITSUBISHI KAGAKU MEDIA CO., LTD. (JP) 2012-11-13 — — US disclosed
US-20110311752-A1 OPTICAL RECORDING MEDIUM, OPTICAL RECORDING MATERIAL AND METAL COMPLEX COMPOUND MITSUBISHI KAGAKU MEDIA CO., LTD. (JP) 2011-12-22 — — US disclosed
US-20090263611-A1 OPTICAL RECORDING MEDIUM, OPTICAL RECORDING MATERIAL AND METAL COMPLEX COMPOUND MITSUBISHI KAGAKU MEDIA CO., LTD. (JP) 2009-10-22 — — US disclosed
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