SCHEMBL11039261

SCHEMBL11039261

Nc1cc(OP(=O)(O)O)ccc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
INPPL1 O15357 6/20 0.53
INPP5A Q14642 4/20 0.53
ALDH1A1 P00352 4/20 0.53
GAA P10253 3/20 0.53
MAPT P10636 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
BLM P54132 2/20 0.53
THRB P10828 2/20 0.53
KDM4E B2RXH2 1/20 0.53
MEN1 O00255 1/20 0.53
RECQL P46063 1/20 0.53
KMT2A Q03164 1/20 0.53
MCL1 Q07820 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
SRC P12931 2/20 0.45
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
HSD17B10 Q99714 3/20 0.41

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
SCHEMBL30433804 0.84 INPPL1 (0.57) INPPL1INPP5ABLMSRCCA1
SCHEMBL29188145 0.84 INPPL1 (0.57) INPPL1INPP5ABLMSRCCA1
SCHEMBL842250 0.82 INPPL1 (0.59) INPPL1INPP5ABLMKDM4EMEN1
SCHEMBL11037254 0.79 INPPL1 (0.52) INPPL1INPP5ABLMSRCCA1
SCHEMBL11037860 0.79 INPPL1 (0.52) INPPL1INPP5AALDH1A1MAPTBLM
SCHEMBL11043751 0.79 INPPL1 (0.52) INPPL1INPP5ABLMKDM4EMEN1
SCHEMBL19435239 0.77 INPPL1 (0.53) INPPL1INPP5ABLMKDM4ESRC
SCHEMBL5705521 0.77 INPPL1 (0.53) INPPL1INPP5ABLMSRCCA1
SCHEMBL11038048 0.77 ALDH1A1 (0.59) INPPL1INPP5AALDH1A1GAAMAPT
SCHEMBL8386637 0.74 INPPL1 (0.65) INPPL1INPP5ABLMSRCCA1

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
US-4230618-A CELLULOSE ICI UNITED STATES, INC. (US) 1980-10-28 US claimed
US-4472308-A Azo dyestuffs containing an amino or acylated amino naphthol monosulfonic acid radical and at least one reactive phosphoric or phosphonic acid group ICI UNITED STATES, INC. (US) 1984-09-18 US disclosed
US-4230618-A CELLULOSE ICI UNITED STATES, INC. (US) 1980-10-28 US disclosed