SCHEMBL13580307

SCHEMBL13580307

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)cc3Cl)c(Cl)c2)C=C(C(C)(C)C)C1=O

nearest known ligand 0.36

Predicted protein targets (top 7)

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 1/20 0.31
▸ PTGS2 P35354 1/20 0.31
▸ SMN1; SMN2 Q16637 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
SCHEMBL13580378 0.93 NPC1 (0.33) NPC1KMT2AATMGPR35PTGS1
SCHEMBL13580395 0.91 NPC1 (0.32) NPC1KMT2AATMGPR35
SCHEMBL13580418 0.90 NPC1 (0.36) NPC1KMT2AATMGPR35SMN1; SMN2
SCHEMBL13580328 0.85 SENP2 (0.37) NPC1KMT2AATMGPR35SMN1; SMN2
SCHEMBL13580330 0.85 NPC1 (0.36) NPC1KMT2AATMGPR35PTGS1
SCHEMBL13580322 0.84 NPC1 (0.36) NPC1KMT2AATMGPR35SMN1; SMN2
SCHEMBL13580317 0.84 NPC1 (0.36) NPC1KMT2AATMGPR35SMN1; SMN2
SCHEMBL13580358 0.84 NPC1 (0.33) NPC1KMT2AATMGPR35PTGS2
SCHEMBL141575 0.83 ATM (0.36) NPC1KMT2AATMGPR35SMN1; SMN2
SCHEMBL13580484 0.83 ATM (0.36) 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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