SCHEMBL13580416

SCHEMBL13580416

CC(C)(C)C1=CC(=C/N=N/c2ccccc2-c2ccccc2/N=N/C=C2C=C(C(C)(C)C)C(=O)C(C(C)(C)C)=C2)C=C(C(C)(C)C)C1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ NPC1 O15118 5/20 0.36
▸ ATM Q13315 3/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ GPR35 Q9HC97 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.35
▸ RAB9A P51151 4/20 0.35
▸ MAPT P10636 4/20 0.35
▸ HPGD P15428 2/20 0.35
▸ NPSR1 Q6W5P4 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ LMNA P02545 2/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ HTT P42858 2/20 0.35
▸ GAA P10253 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ HKDC1 Q2TB90 1/20 0.35
▸ POLB P06746 2/20 0.33
▸ GPR55 Q9Y2T6 1/20 0.33
▸ PLA2G1B P04054 1/20 0.32

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
SCHEMBL13580429 0.88 SMN1; SMN2 (0.39) SMN1; SMN2NPC1ATMKMT2AGPR35
SCHEMBL13580431 0.88 NPC1 (0.37) SMN1; SMN2NPC1ATMKMT2AGPR35
SCHEMBL18877740 0.86 SMN1; SMN2 (0.43) SMN1; SMN2NPC1ATMKMT2AGPR35
SCHEMBL18877733 0.86 SMN1; SMN2 (0.43) SMN1; SMN2NPC1ATMKMT2AGPR35
SCHEMBL18877741 0.86 SMN1; SMN2 (0.43) SMN1; SMN2NPC1ATMKMT2AGPR35
SCHEMBL13580435 0.85 SMN1; SMN2 (0.36) SMN1; SMN2NPC1ATMKMT2AGPR35
SCHEMBL13580347 0.85 SMN1; SMN2 (0.39) SMN1; SMN2NPC1ATMKMT2AGPR35
SCHEMBL13580412 0.84 SMN1; SMN2 (0.36) SMN1; SMN2NPC1ATMKMT2AGPR35
SCHEMBL14280240 0.83 SMN1; SMN2 (0.41) SMN1; SMN2NPC1KMT2AALDH1A1RAB9A
SCHEMBL13580421 0.83 SMN1; SMN2 (0.36) SMN1; SMN2NPC1ATMKMT2AGPR35

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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