SCHEMBL3421153

SCHEMBL3421153

CC(O)Oc1[c]ccc(C(C)(c2ccccc2)c2cc[c]c(OC(C)O)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.41
ESR2 Q92731 2/20 0.41
ALDH1A1 P00352 1/20 0.33
ALOX15 P16050 1/20 0.33
MAPK1 P28482 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
SCHEMBL3421156 0.75 ESR1 (0.40) ESR1ESR2ALDH1A1ALOX15MAPK1
SCHEMBL3359572 0.72 ESR1 (0.57) ESR1ESR2ALDH1A1ALOX15
SCHEMBL3043431 0.70 LMNA (0.31)
SCHEMBL8575937 0.68 ADRA2A (0.36) MAPK1
SCHEMBL2164357 0.65 ESR1 (0.54) ESR1ESR2ALDH1A1ALOX15MAPK1
SCHEMBL15352508 0.65 PDE2A (0.38) ALDH1A1
SCHEMBL430941 0.64 ESR1 (0.70) ESR1ESR2ALDH1A1ALOX15MAPK1
SCHEMBL8335012 0.64 ESR1 (0.70) ESR1ESR2ALDH1A1ALOX15MAPK1
SCHEMBL6515056 0.63 ALDH1A1 (0.52) ESR1ESR2ALDH1A1
SCHEMBL5887915 0.62 ESR1 (0.75) ESR1ESR2ALDH1A1ALOX15MAPK1

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-1806618-B1 POSITIVE PHOTOSENSITIVE INSULATING RESIN COMPOSITION AND CURED PRODUCT THEREOF JSR CORP (JP) 2010-06-09 EP claimed