SCHEMBL13580348

SCHEMBL13580348

CC(C)(C)C1=CC(=C/N=N/c2ccc(-c3ccc(/N=N/C=C4C=C(C(C)(C)C)C(=O)C(C(C)(C)C)=C4)cc3-c3ccccc3)c(-c3ccccc3)c2)C=C(C(C)(C)C)C1=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ ATM Q13315 2/20 0.34
▸ GPR35 Q9HC97 1/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ GPR55 Q9Y2T6 1/20 0.33
▸ PTGS2 P35354 3/20 0.32
▸ MAOA P21397 1/20 0.31
▸ MAOB P27338 1/20 0.31
▸ RAB9A P51151 2/20 0.31
▸ L3MBTL1 Q9Y468 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ APAF1 O14727 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ XBP1 P17861 1/20 0.31
▸ PTBP1 P26599 1/20 0.31
▸ HTT P42858 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
SCHEMBL13580394 0.95 PTGS2 (0.35) NPC1KMT2AATMGPR35SMN1; SMN2
SCHEMBL13580353 0.89 NPC1 (0.33) NPC1KMT2AATMGPR35PTGS2
SCHEMBL13580828 0.89 NPC1 (0.33) NPC1KMT2AATMGPR35
SCHEMBL13580827 0.88 NPC1 (0.33) NPC1KMT2AATMGPR35
SCHEMBL13580358 0.88 NPC1 (0.33) NPC1KMT2AATMGPR35PTGS2
SCHEMBL13580406 0.87 PTGS2 (0.31) PTGS2
SCHEMBL13580401 0.86 SMN1; SMN2 (0.33) NPC1KMT2AATMGPR35SMN1; SMN2
SCHEMBL13580362 0.86 NPC1 (0.39) NPC1KMT2AATMGPR35SMN1; SMN2
SCHEMBL13580361 0.86 APP (0.34) NPC1KMT2AATMGPR35POLB
SCHEMBL13580359 0.85 PTGS2 (0.38) KMT2ASMN1; SMN2PTGS2MAOAMAOB

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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