SCHEMBL9616973

SCHEMBL9616973

CC1C(N(C)C)C(=O)N(c2ccccc2)N1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LOX P28300 1/20 0.39
▸ LOXL3 P58215 1/20 0.39
▸ LOXL4 Q96JB6 1/20 0.39
▸ LOXL2 Q9Y4K0 1/20 0.39
▸ MAOA P21397 1/20 0.37
▸ LMNA P02545 4/20 0.36
▸ PTGS1 P23219 2/20 0.36
▸ ABCB11 O95342 1/20 0.36
▸ GSK3A P49840 2/20 0.35
▸ GSK3B P49841 2/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ CYP1A2 P05177 2/20 0.34
▸ TSHR P16473 2/20 0.34
▸ NAPRT Q6XQN6 2/20 0.34
▸ FPR1 P21462 1/20 0.34
▸ ALOX5 P09917 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ ALDH1A1 P00352 5/20 0.33
▸ MAPT P10636 3/20 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
SCHEMBL1425324 0.79 MAPT (0.44) LOXLOXL3LOXL4LOXL2MAOA
SCHEMBL4291668 0.79 PTGS1 (0.43) LOXLOXL3LOXL4LOXL2MAOA
SCHEMBL14446344 0.79 LOX (0.43) LOXLOXL3LOXL4LOXL2MAOA
SCHEMBL1425325 0.78 PTGS1 (0.42) LOXLOXL3LOXL4LOXL2LMNA
SCHEMBL13415787 0.76 LMNA (0.45) LOXLOXL3LOXL4LOXL2MAOA
SCHEMBL9616703 0.76 LOX (0.41) LOXLOXL3LOXL4LOXL2MAOA
SCHEMBL19829483 0.73 LOX (0.39) LOXLOXL3LOXL4LOXL2MAOA
SCHEMBL2784650 0.73 LMNA (0.40) LOXLOXL3LOXL4LOXL2MAOA
SCHEMBL8217266 0.70 LOX (0.36) LOXLOXL3LOXL4LOXL2MAOA
SCHEMBL30834844 0.68 POLB (0.35) LOXLOXL3LOXL4LOXL2MAOA

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
JP-4200395-A — — None — — JP disclosed
JP-H04200395-A TEST PIECE FOR DETECTING SUBSTANCE HAVING PEROXIDASE ACTION GODO SHIYUSEI KK 1992-07-21 — — JP disclosed
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