SCHEMBL7646753

SCHEMBL7646753

O=C(O)c1cc(O)cc2[nH]nnc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.38
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
CA7 P43166 3/20 0.38
CA9 Q16790 3/20 0.38
CA14 Q9ULX7 3/20 0.38
ALOX5 P09917 1/20 0.37
PTGS2 P35354 1/20 0.37
DHODH Q02127 5/20 0.36
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
ALPL P05186 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ESR2 Q92731 1/20 0.33
HCAR1 Q9BXC0 3/20 0.32
PARP1 P09874 1/20 0.32
CDC25B P30305 1/20 0.32
HCAR2 Q8TDS4 3/20 0.32
SMAD3 P84022 1/20 0.32
DAO P14920 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
SCHEMBL10627235 0.76 MAPT (0.52) CA1CA2ALDH1A1
SCHEMBL15987188 0.76 DHODH (0.58) DHODH
SCHEMBL29893733 0.76 MAPT (0.52) CA1CA2ALDH1A1
SCHEMBL6051981 0.75 ESR1 (0.34)
Silver SCHEMBL9170884 0.74 MAPT (0.51) CA1CA2ALDH1A1
SCHEMBL9170890 0.74 MAPT (0.51) CA1CA2ALDH1A1
SCHEMBL9172800 0.73 ESR1 (0.33)
SCHEMBL25111865 0.73 HCAR2 (0.32) ALDH1A1PARP1HCAR2
SCHEMBL29453826 0.73 KDM4E (0.47) DHODHALDH1A1PARP1
SCHEMBL170674 0.73 KDM4E (0.47) DHODHALDH1A1PARP1

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-20020086249-A1 Method of processing silver halide color photographic lightsensitive material FUJIFILM CORPORATION (JP) 2002-07-04 US disclosed