SCHEMBL10600623

SCHEMBL10600623

O=S(=O)(c1cc(O)c(O)c(O)c1O)c1cc(O)c(O)c(O)c1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HKDC1 Q2TB90 1/20 0.38
MCL1 Q07820 2/20 0.38
BCL2 P10415 1/20 0.38
TDP1 Q9NUW8 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
ALPL P05186 1/20 0.35
ALPI P09923 1/20 0.35
ALPG P10696 1/20 0.35
DNMT1 P26358 1/20 0.35
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
HPGD P15428 2/20 0.34
MAPK1 P28482 2/20 0.34
HSD17B10 Q99714 2/20 0.34
MEN1 O00255 1/20 0.34
TTR P02766 1/20 0.34
CYP1A1 P04798 1/20 0.34

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
SCHEMBL669090 0.82 PGAM1 (0.48) MCL1BCL2TDP1CA1CA2
SCHEMBL899970 0.81 POLB (0.58) HKDC1TDP1MEN1KMT2APOLB
SCHEMBL28750510 0.78 SELL (0.39) HKDC1MCL1TDP1L3MBTL1ALPL
SCHEMBL2113616 0.75 CA1 (0.45) CA1CA2ALDH1A1HPGDMAPK1
SCHEMBL2114395 0.74 SELL (0.41) MCL1BCL2TDP1L3MBTL1ALPL
SCHEMBL2113606 0.73 CA1 (0.53) CA1CA2ALDH1A1HPGDHSD17B10
SCHEMBL28958619 0.73 SELL (0.39) HKDC1MCL1TDP1L3MBTL1ALPL
SCHEMBL9646829 0.70 HKDC1 (0.51) HKDC1MCL1TDP1L3MBTL1ALPL
SCHEMBL1961108 0.69 SELL (0.47) MCL1BCL2TDP1L3MBTL1CA1
SCHEMBL1890371 0.69 MPL (0.38) TDP1ALDH1A1HPGDHSD17B10MMP14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0203468-B1 IMPROVED PHOTOGRAPHIC MATERIAL FOR TANNING DEVELOPMENT AND METHOD FOR OBTAINING A RELIEF IMAGE MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1989-03-08 EP claimed
EP-0203468-B1 IMPROVED PHOTOGRAPHIC MATERIAL FOR TANNING DEVELOPMENT AND METHOD FOR OBTAINING A RELIEF IMAGE MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1989-03-08 EP disclosed
US-4501832-A CONTAING POLYAMINE CURING AGENT AND NITROPARAFFIN DEFT CHEMICAL COATINGS, INC. (US) 1985-02-26 US disclosed
US-4495317-A CONTAINING POLYAMINE AND CONTAINING POLYAMINOIMIDAZOLINE BISPHENOLA, DIGYCIDYL ETHER, AND NITROPARAFFIN DEFT CHEMICAL COATINGS, INC. (US) 1985-01-22 US disclosed
US-4352898-A NITROPARAFFIN, POLYAMINE CURING AGENT DEFT, INC. (US) 1982-10-05 US disclosed