SCHEMBL5866769

SCHEMBL5866769

C=CCOc1c(C)cc(C(c2cc(C)c(OCC=C)c(C)c2)c2cc(C)c(OCC=C)c(C)c2)cc1C

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.35
PTGS2 P35354 3/20 0.35
ALDH1A1 P00352 3/20 0.35
GAA P10253 2/20 0.35
HPGD P15428 1/20 0.35
LMNA P02545 2/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
MGAM O43451 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
SCN4A P35499 4/20 0.32
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32
TLR4 O00206 1/20 0.32
KDM4E B2RXH2 1/20 0.31
CXCR5 P32302 1/20 0.31

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
SCHEMBL21775788 0.90 ALDH1A1 (0.33) PTGS1PTGS2ALDH1A1GAAHPGD
SCHEMBL23627378 0.87 GAA (0.32) PTGS1PTGS2ALDH1A1GAAHPGD
SCHEMBL25926103 0.82 PTGS1 (0.33) PTGS1PTGS2ALDH1A1GAAHPGD
SCHEMBL8161008 0.82 POLB (0.39) PTGS1PTGS2ALDH1A1GAAHPGD
SCHEMBL472102 0.82 PTGS1 (0.38) PTGS1PTGS2ALDH1A1GAAHPGD
SCHEMBL21775778 0.81 PTGS1 (0.31) PTGS1PTGS2
SCHEMBL21888875 0.80 MGLL (0.42) ALDH1A1GAAHPGDLMNANPSR1
SCHEMBL14394607 0.78 ALDH1A1 (0.36) PTGS1PTGS2ALDH1A1GAAHPGD
SCHEMBL12299699 0.78 PTGS1 (0.36) PTGS1PTGS2ALDH1A1GAAHPGD
SCHEMBL262332 0.78 MEN1 (0.41) PTGS1PTGS2ALDH1A1GAAHPGD

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-7049388-B2 Process for manufacturing an α-dihydroxy derivative and epoxy resins prepared therefrom DOW GLOBAL TECHNOLOGIES INC. (US) 2006-05-23 US claimed
US-6646102-B2 Epoxidizing an alpha - halohydrin intermediate produced from a halide substitution of an alpha -dihydroxy derivative which has been obtained by a dihydroxylation reaction of an aryl allyl ether, oxidation catalysts DOW GLOBAL TECHNOLOGIES INC. 2003-11-11 US claimed
US-20030105268-A1 Process for manufacturing an alpha-dihydroxy derivative and epoxy resins prepared therefrom DOW GLOBAL TECHNOLOGIES INC. 2003-06-05 US claimed