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SCHEMBL13580340

SCHEMBL13580340

CC(C)(C)C1=CC(=C/N=N/c2cc(C(F)(F)F)c(-c3cc(Cl)c(/N=N/C=C4C=C(C(C)(C)C)C(=O)C(C(C)(C)C)=C4)cc3C(F)(F)F)cc2Cl)C=C(C(C)(C)C)C1=O

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ GPR35 Q9HC97 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
SCHEMBL13580445 0.94 — —
SCHEMBL13580327 0.89 NPC1 (0.33) NPC1KMT2AATMGPR35
SCHEMBL13580403 0.86 — —
SCHEMBL13580309 0.86 NPC1 (0.34) NPC1KMT2AATMGPR35
SCHEMBL13580335 0.86 NPC1 (0.31) NPC1KMT2AATMGPR35
SCHEMBL13580337 0.86 NPC1 (0.31) NPC1KMT2AATMGPR35
SCHEMBL13580345 0.86 NPC1 (0.31) NPC1KMT2AATMGPR35
SCHEMBL13580391 0.85 AKR1C3 (0.33) —
SCHEMBL13580333 0.83 NPC1 (0.32) NPC1KMT2AATMGPR35
SCHEMBL13580444 0.81 NPC1 (0.31) NPC1KMT2AATMGPR35

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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