SCHEMBL8117166

SCHEMBL8117166

O=c1cc(O)c2c(Br)cccc2o1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 3/20 0.55
CA12 O43570 2/20 0.55
CA1 P00915 1/20 0.55
PIM1 P11309 1/20 0.50
ALDH1A1 P00352 6/20 0.44
KDM4E B2RXH2 3/20 0.44
KMT2A Q03164 2/20 0.44
MAP1LC3B Q9GZQ8 1/20 0.44
TRPC5 Q9UL62 1/20 0.43
CYP3A4 P08684 3/20 0.42
HPGD P15428 3/20 0.42
TSHR P16473 2/20 0.42
CASP1 P29466 2/20 0.42
CASP7 P55210 2/20 0.42
HSD17B10 Q99714 2/20 0.42
ALOX15 P16050 3/20 0.42
MAPK1 P28482 2/20 0.42
TTR P02766 1/20 0.40
MAOA P21397 2/20 0.40
GAA P10253 3/20 0.39

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
SCHEMBL10794104 0.85 CA12 (0.50) CA9CA12CA1PIM1ALDH1A1
SCHEMBL5114485 0.82 CA9 (0.60) CA9CA12CA1PIM1ALDH1A1
SCHEMBL24753975 0.82 CA12 (0.56) CA9CA12CA1PIM1ALDH1A1
SCHEMBL5342252 0.78 CA9 (0.55) CA9CA12CA1PIM1ALDH1A1
SCHEMBL5346812 0.78 ALDH1A1 (0.59) CA9CA12CA1ALDH1A1KDM4E
SCHEMBL3910257 0.78 CA9 (0.55) CA9CA12CA1PIM1ALDH1A1
SCHEMBL8114895 0.78 CA9 (0.55) CA9CA12CA1PIM1ALDH1A1
SCHEMBL25607742 0.76 CA9 (0.62) CA9CA12CA1PIM1ALDH1A1
SCHEMBL8105516 0.74 CA9 (0.50) CA9CA12CA1PIM1ALDH1A1
SCHEMBL8114801 0.74 CA9 (0.50) CA9CA12CA1PIM1ALDH1A1

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-6114546-A Aminomethylene derivatives and ultraviolet absorbent comprising thereof CHEMIPRO KASEI KAISHA, LIMITED (JP) 2000-09-05 US disclosed
EP-0950655-A1 AMINOMETHYLENE DERIVATIVES AND ULTRAVIOLET ABSORBER COMPRISING THE SAME CHEMIPRO KASEI KAISHA, LIMITED (JP) 1999-10-20 EP disclosed