SCHEMBL13580357

SCHEMBL13580357

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)c(-c4ccccc4)c3)cc2-c2ccccc2)C=C(C(C)(C)C)C1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ NPC1 O15118 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ ATM Q13315 2/20 0.34
▸ GPR35 Q9HC97 1/20 0.34
▸ CASP3 P42574 1/20 0.33
▸ SENP8 Q96LD8 1/20 0.33
▸ SENP7 Q9BQF6 1/20 0.33
▸ SENP6 Q9GZR1 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ APAF1 O14727 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ XBP1 P17861 1/20 0.33
▸ PTBP1 P26599 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ GALK1 P51570 1/20 0.33
▸ BLM P54132 1/20 0.33

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 0.95 SMN1; SMN2 (0.36) SMN1; SMN2NPC1KMT2AATMGPR35
SCHEMBL13580397 0.94 CASP3 (0.35) SMN1; SMN2NPC1KMT2AATMGPR35
SCHEMBL13580399 0.93 SMN1; SMN2 (0.32) SMN1; SMN2NPC1KMT2AATMGPR35
SCHEMBL13580405 0.93 SMN1; SMN2 (0.32) SMN1; SMN2NPC1KMT2AATMGPR35
SCHEMBL13580431 0.87 NPC1 (0.37) SMN1; SMN2NPC1KMT2AATMGPR35
SCHEMBL13580401 0.86 SMN1; SMN2 (0.33) SMN1; SMN2NPC1KMT2AATMGPR35
SCHEMBL13580355 0.83 SMN1; SMN2 (0.34) SMN1; SMN2NPC1KMT2AATMGPR35
SCHEMBL13580416 0.83 SMN1; SMN2 (0.44) SMN1; SMN2NPC1KMT2AATMGPR35
SCHEMBL13580429 0.83 SMN1; SMN2 (0.39) SMN1; SMN2NPC1KMT2AATMGPR35
SCHEMBL13580329 0.82 KMT2A (0.39) SMN1; SMN2NPC1KMT2AATMGPR35

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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