SCHEMBL8637897

SCHEMBL8637897

O=S(=O)(O)c1cc(Nc2cc(Oc3ccccc3)nc(Oc3ccccc3)n2)ccc1/C=C/c1ccc(Nc2cc(Oc3ccccc3)nc(Oc3ccccc3)n2)cc1S(=O)(=O)O.[NaH].[NaH]

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.39
ALDH1A1 P00352 2/20 0.38
GAA P10253 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
NUDT1 P36639 1/20 0.36
RAD51 Q06609 1/20 0.36
SNCA P37840 1/20 0.35
MAPK8 P45983 2/20 0.33
MAPK10 P53779 1/20 0.33
PGR P06401 2/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
KDR P35968 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
POLB P06746 1/20 0.32
RXFP1 Q9HBX9 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
SCHEMBL8985696 1.00 ENPP2 (0.39) ENPP2ALDH1A1GAACA1CA2
SCHEMBL9115068 0.99 ENPP2 (0.40) ENPP2ALDH1A1GAACA1CA2
SCHEMBL9115036 0.99 ENPP2 (0.40) ENPP2ALDH1A1GAACA1CA2
SCHEMBL8637932 0.98 CA1 (0.40) ENPP2ALDH1A1GAACA1CA2
Diethylamine SCHEMBL8437654 0.92 ENPP2 (0.38) ENPP2ALDH1A1GAACA1CA2
Diethylamine SCHEMBL8437676 0.92 ENPP2 (0.38) ENPP2ALDH1A1GAACA1CA2
Diethylamine SCHEMBL8437686 0.92 ENPP2 (0.38) ENPP2ALDH1A1GAACA1CA2
SCHEMBL9453533 0.92 ENPP2 (0.37) ENPP2ALDH1A1GAACA1CA2
SCHEMBL8015107 0.92 ENPP2 (0.37) ENPP2ALDH1A1GAACA1CA2
SCHEMBL9453515 0.92 ENPP2 (0.37) ENPP2ALDH1A1GAACA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0481333-B1 A silver halide color photographic material FUJI PHOTO FILM CO LTD (JP) 1998-08-12 EP disclosed
EP-0313022-B1 SILVER HALIDE PHOTOSENSITIVE MATERIAL FUJI PHOTO FILM CO., LTD. (JP) 1993-03-31 EP disclosed
EP-0481333-A1 A silver halide color photographic material Fuji Photo Film Co., Ltd. (JP) 1992-04-22 EP disclosed