SCHEMBL13580330

SCHEMBL13580330

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)cc3O)c(O)c2)C=C(C(C)(C)C)C1=O

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ GPR35 Q9HC97 1/20 0.36
▸ PTGS1 P23219 2/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ GLO1 Q04760 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
SCHEMBL13580328 0.86 SENP2 (0.37) NPC1KMT2AATMGPR35SMN1; SMN2
SCHEMBL13580317 0.85 NPC1 (0.36) NPC1KMT2AATMGPR35SMN1; SMN2
SCHEMBL13580307 0.85 NPC1 (0.36) NPC1KMT2AATMGPR35PTGS1
SCHEMBL13580322 0.85 NPC1 (0.36) NPC1KMT2AATMGPR35SMN1; SMN2
SCHEMBL13580827 0.85 NPC1 (0.33) NPC1KMT2AATMGPR35GLO1
SCHEMBL13580331 0.83 KMT2A (0.34) NPC1KMT2AATMGPR35
SCHEMBL13580326 0.83 NPC1 (0.34) NPC1KMT2AATMGPR35
SCHEMBL13580418 0.83 NPC1 (0.36) NPC1KMT2AATMGPR35SMN1; SMN2
SCHEMBL13580348 0.82 NPC1 (0.34) NPC1KMT2AATMGPR35PTGS2
SCHEMBL13580310 0.81 ATM (0.38) NPC1KMT2AATMGPR35SMN1; SMN2

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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