SCHEMBL12374700

SCHEMBL12374700

Cc1cccc(/C=C/C(=O)c2c(C)c(C)c(C)n(C)c2=O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.50
MAOB P27338 2/20 0.50
MAPT P10636 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
XBP1 P17861 1/20 0.46
ALOX12 P18054 1/20 0.46
RECQL P46063 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
HSP90AA1 P07900 1/20 0.44
ATM Q13315 1/20 0.44
CA1 P00915 2/20 0.43

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
SCHEMBL14514849 0.90 MAPT (0.50) MAOAMAOBMAPTKMT2AKDM4E
SCHEMBL12374696 0.87 KMT2A (0.52) MAOAMAOBMAPTKMT2AMEN1
SCHEMBL14514847 0.83 MAPT (0.54) MAOAMAOBMAPTKMT2AKDM4E
SCHEMBL12374862 0.83 PADI4 (0.51) MAOAMAOBMAPTKMT2AKDM4E
SCHEMBL12374832 0.82 MAOB (0.50) MAOAMAOBMAPTKMT2AKDM4E
SCHEMBL15233123 0.81 MAOA (0.49) MAOAMAOBMAPTKMT2AKDM4E
SCHEMBL13818140 0.79 MAOA (0.43) MAOAMAOBMAPTKMT2AKDM4E
SCHEMBL14514848 0.75 MAPT (0.45) MAOAMAOBMAPTKMT2AKDM4E
SCHEMBL5599099 0.74 CYP1A2 (0.61) MAOAMAOBMAPTKMT2AKDM4E
SCHEMBL5599097 0.74 CYP1A2 (0.61) MAOAMAOBMAPTKMT2AKDM4E

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989478-B2 decreases expression of a Type I collage gene in a tissue to induce a reduction in accumulation of collagen and thereby improves tissue fibrosis SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-02 US disclosed