SCHEMBL13580431

SCHEMBL13580431

CC(C)(C)C1=CC(=C/N=N/c2ccccc2-c2ccc(-c3ccccc3)cc2/N=N/C=C2C=C(C(C)(C)C)C(=O)C(C(C)(C)C)=C2)C=C(C(C)(C)C)C1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ ATM Q13315 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ APAF1 O14727 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ XBP1 P17861 1/20 0.37
▸ PTBP1 P26599 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ GALK1 P51570 1/20 0.37
▸ BLM P54132 1/20 0.37
▸ SMAD3 P84022 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ GPR35 Q9HC97 1/20 0.32
▸ MAOA P21397 1/20 0.32

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
SCHEMBL13580421 0.90 SMN1; SMN2 (0.36) NPC1SMN1; SMN2KMT2AATMRAB9A
SCHEMBL13580416 0.88 SMN1; SMN2 (0.44) NPC1SMN1; SMN2KMT2AATMRAB9A
SCHEMBL13580357 0.87 SMN1; SMN2 (0.36) NPC1SMN1; SMN2KMT2AATMRAB9A
SCHEMBL13580438 0.87 SMN1; SMN2 (0.32) NPC1SMN1; SMN2KMT2AATMRAB9A
SCHEMBL13580397 0.84 CASP3 (0.35) NPC1SMN1; SMN2KMT2AATMRAB9A
SCHEMBL13580429 0.82 SMN1; SMN2 (0.39) NPC1SMN1; SMN2KMT2AATMRAB9A
SCHEMBL13580435 0.82 SMN1; SMN2 (0.36) NPC1SMN1; SMN2KMT2AATMGPR35
SCHEMBL13580405 0.81 SMN1; SMN2 (0.32) NPC1SMN1; SMN2KMT2AATMGPR35
SCHEMBL13580399 0.81 SMN1; SMN2 (0.32) NPC1SMN1; SMN2KMT2AATMGPR35
SCHEMBL13580401 0.81 SMN1; SMN2 (0.33) NPC1SMN1; SMN2KMT2AATMGPR35

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 2 patents. 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
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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