SCHEMBL10749005

SCHEMBL10749005

O=C1NC(=O)C(c2cccc(O)c2O)N1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HTT P42858 1/20 0.41
GAA P10253 4/20 0.40
DBH P09172 2/20 0.38
ALDH1A1 P00352 4/20 0.37
HPGD P15428 2/20 0.37
ALOX15 P16050 2/20 0.37
HSD17B10 Q99714 2/20 0.37
LMNA P02545 2/20 0.37
ADAMTS4 O75173 1/20 0.37
EGFR P00533 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
FYN P06241 1/20 0.37
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
MMP8 P22894 1/20 0.37
CA6 P23280 1/20 0.37
CDK2 P24941 1/20 0.37

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
SCHEMBL11500142 0.88 GAA (0.44) TDP1SMN1; SMN2HTTGAADBH
SCHEMBL11566163 0.86 TDP1 (0.52) TDP1HTTGAAALDH1A1HPGD
SCHEMBL6277589 0.86 TDP1 (0.52) TDP1HTTGAAALDH1A1HPGD
SCHEMBL7389037 0.83 TDP1 (0.45) TDP1SMN1; SMN2HTTGAAALDH1A1
SCHEMBL11500225 0.76 HTT (0.40) TDP1SMN1; SMN2HTTGAAALDH1A1
SCHEMBL11653951 0.76 GAA (0.44) TDP1SMN1; SMN2HTTGAAALDH1A1
SCHEMBL12595185 0.75 MAPT (0.60) TDP1SMN1; SMN2HTTGAAALDH1A1
SCHEMBL10737116 0.73 POLB (0.47) TDP1GAAALDH1A1HPGDALOX15
SCHEMBL11651079 0.72 GAA (0.47) TDP1HTTGAAALDH1A1HPGD
SCHEMBL30588975 0.72 IDO1 (0.55) TDP1SMN1; SMN2HTTALDH1A1HPGD

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-4672101-A Polyepoxy aromatic hydantoins THE DOW CHEMICAL COMPANY (US) 1987-06-09 US disclosed