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SCHEMBL13580860

SCHEMBL13580860

Cc1ccc(-c2ccc(/N=N/C=C3C=C(C(C)(C)C)C(=O)C(C(C)(C)C)=C3)cc2)c(/N=N\C=C2C=C(C(C)(C)C)C(=O)C(C(C)(C)C)=C2)c1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.32
▸ ATM Q13315 2/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ GPR35 Q9HC97 1/20 0.32
▸ MAPT P10636 1/20 0.30
▸ PKM P14618 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ L3MBTL1 Q9Y468 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
SCHEMBL13580432 0.88 NPC1 (0.32) NPC1ATMKMT2AGPR35
SCHEMBL13580353 0.86 NPC1 (0.33) NPC1ATMKMT2AGPR35
SCHEMBL13580429 0.85 SMN1; SMN2 (0.39) NPC1ATMKMT2AGPR35MAPT
SCHEMBL13580738 0.84 NPC1 (0.32) NPC1ATMKMT2AGPR35
SCHEMBL13580433 0.84 NPC1 (0.32) NPC1ATMKMT2AGPR35
SCHEMBL14280269 0.84 NPC1 (0.37) NPC1ATMKMT2AGPR35MAPT
SCHEMBL13580401 0.83 SMN1; SMN2 (0.33) NPC1ATMKMT2AGPR35
SCHEMBL13580310 0.83 ATM (0.38) NPC1ATMKMT2AGPR35MAPT
SCHEMBL13580393 0.81 KMT2A (0.38) NPC1ATMKMT2AGPR35MAPT
SCHEMBL13580378 0.81 NPC1 (0.33) NPC1ATMKMT2AGPR35

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090317733-A1 Quinone Compound, Electrophotographic Photoconductor and Electrophotographic Apparatus FUJI ELECTRIC DEVICE TECHNOLOGY CO., LTD. (JP) 2009-12-24 — — US disclosed
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