SCHEMBL14626799

SCHEMBL14626799

OC(O)C[C@H]1CC[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGFR P43088 15/20 0.51
PTGER1 P34995 6/20 0.51
PTGER2 P43116 1/20 0.51
SLCO2A1 Q92959 1/20 0.46
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
ABCB11 O95342 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
PTGER3 P43115 1/20 0.40

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
SCHEMBL14627042 0.84 MMP12 (0.38) PTGFRPTGER1PTGER2SLCO2A1KDM4E
SCHEMBL24225681 0.84 PTGFR (0.48) PTGFRPTGER1PTGER2SLCO2A1KDM4E
SCHEMBL11724925 0.80 PTGFR (0.55) PTGFRPTGER1PTGER2SLCO2A1KDM4E
SCHEMBL13665633 0.79 PTGFR (0.55) PTGFRPTGER1PTGER2SLCO2A1KDM4E
SCHEMBL12721160 0.76 SLCO2A1 (0.75) PTGFRPTGER1PTGER2SLCO2A1KDM4E
SCHEMBL22350151 0.75 PTGER1 (0.49) PTGFRPTGER1PTGER2SLCO2A1
SCHEMBL22350147 0.75 PTGER1 (0.49) PTGFRPTGER1PTGER2SLCO2A1
SCHEMBL27516839 0.74 PTGER1 (0.48) PTGFRPTGER1PTGER2SLCO2A1
SCHEMBL24226152 0.74 PTGFR (0.67) PTGFRPTGER1PTGER2SLCO2A1KDM4E
SCHEMBL14627145 0.74 PTGFR (0.67) PTGFRPTGER1PTGER2SLCO2A1KDM4E

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-7157590-B2 Chemical intermediate for vision defect drug FINETECH LABORATORIES LTD. (IL) 2007-01-02 US disclosed