SCHEMBL12034282

SCHEMBL12034282

CCCn1nc(N=NC2=C(O)COC2=O)cc1C

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 2/20 0.33
▸ PSEN1 P49768 1/20 0.32
▸ PSEN2 P49810 1/20 0.32
▸ APH1B Q8WW43 1/20 0.32
▸ NCSTN Q92542 1/20 0.32
▸ APH1A Q96BI3 1/20 0.32
▸ PSENEN Q9NZ42 1/20 0.32
▸ ADORA2A P29274 1/20 0.31
▸ ADORA2B P29275 1/20 0.31
▸ TYR P14679 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
SCHEMBL12034283 0.84 BAZ2B (0.31) —
SCHEMBL12034274 0.77 EPHX2 (0.32) EPHX2ADORA2AADORA2B
SCHEMBL15134091 0.70 MAPT (0.43) EPHX2ADORA2AADORA2B
SCHEMBL15133250 0.70 MAPT (0.43) EPHX2ADORA2AADORA2B
SCHEMBL12034202 0.68 LMNA (0.35) ADORA2AADORA2B
SCHEMBL13661831 0.67 MAPT (0.45) —
SCHEMBL23400742 0.63 ADORA2A (0.44) EPHX2ADORA2AADORA2BTYR
SCHEMBL8688063 0.61 ALDH1A1 (0.51) —
SCHEMBL12034286 0.61 MPI (0.33) —
SCHEMBL13661846 0.60 NPC1 (0.44) —

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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