SCHEMBL9701195

SCHEMBL9701195

O=C(OC(=O)c1ccc(O)c(O)c1O)c1ccc(O)c(O)c1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SELL P14151 1/20 0.60
SELP P16109 1/20 0.60
HDAC1 Q13547 1/20 0.50
PIK3CA P42336 5/20 0.44
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 3/20 0.43
MAPT P10636 3/20 0.43
RECQL P46063 3/20 0.43
HPGD P15428 2/20 0.43
ALOX15 P16050 2/20 0.43
HSD17B10 Q99714 2/20 0.43
ANTXR2 P58335 3/20 0.42
TERT O14746 1/20 0.42
TLR2 O60603 1/20 0.41
NSD2 O96028 1/20 0.41
POLB P06746 1/20 0.41
PKM P14618 1/20 0.41
MPI P34949 1/20 0.41
GRK6 P43250 1/20 0.41
TLR1 Q15399 1/20 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
SCHEMBL9701212 0.87 SELL (0.52) SELLSELPHDAC1KDM4EALDH1A1
SCHEMBL947039 0.82 CA12 (0.57) SELLSELPHDAC1KDM4EALDH1A1
SCHEMBL31473107 0.82 CA12 (0.57) SELLSELPHDAC1KDM4EALDH1A1
SCHEMBL13286836 0.80 SERPINE1 (0.58) SELLSELPHDAC1PIK3CAKDM4E
SCHEMBL8977742 0.79 SELL (0.52) SELLSELPHDAC1PIK3CAKDM4E
SCHEMBL924425 0.78 SELL (0.62) SELLSELPHDAC1PIK3CAKDM4E
SCHEMBL1063407 0.77 SELL (0.68) SELLSELPHDAC1PIK3CAKDM4E
SCHEMBL639072 0.77 ALDH1A1 (0.61) SELLSELPKDM4EALDH1A1MAPT
SCHEMBL27881419 0.77 CA12 (0.61) SELLSELPHDAC1KDM4EALDH1A1
SCHEMBL31330344 0.76 HDAC1 (0.41) SELLSELPHDAC1KDM4EALDH1A1

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
EP-0507576-A1 Polypropylene-based resin compositions TOSOH CORPORATION (JP) 1992-10-07 EP disclosed