SCHEMBL3241376

SCHEMBL3241376

Cc1cc(CCc2ccc(O)cc2)ccc1O

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.63
ESR2 Q92731 3/20 0.63
IGF1R P08069 2/20 0.57
ALOX15 P16050 2/20 0.57
SLC28A3 Q9HAS3 1/20 0.55
LTA4H P09960 1/20 0.54
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 1/20 0.51
GFER P55789 1/20 0.51
PTGS1 P23219 1/20 0.48
PTGS2 P35354 1/20 0.48
TP53 P04637 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CA2 P00918 1/20 0.46
TMEM97 Q5BJF2 1/20 0.45
SIGMAR1 Q99720 1/20 0.45

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
SCHEMBL27809706 0.94 ESR1 (0.68) ESR1ESR2IGF1RALOX15SLC28A3
SCHEMBL22500464 0.92 IGF1R (0.69) ESR1ESR2IGF1RALOX15SLC28A3
SCHEMBL28999062 0.92 SLC28A3 (0.67) ESR1ESR2IGF1RALOX15SLC28A3
SCHEMBL29720481 0.91 ESR1 (0.74) ESR1ESR2IGF1RALOX15KDM4E
SCHEMBL1924746 0.91 ESR1 (0.74) ESR1ESR2IGF1RALOX15KDM4E
SCHEMBL172708 0.86 ESR1 (0.61) ESR1ESR2IGF1RALOX15KDM4E
SCHEMBL11177663 0.83 ESR1 (0.83) ESR1ESR2IGF1RALOX15KDM4E
SCHEMBL6234291 0.83 ESR1 (0.83) ESR1ESR2IGF1RALOX15KDM4E
SCHEMBL529618 0.83 ESR1 (0.68) ESR1ESR2IGF1RALOX15SLC28A3
SCHEMBL68664 0.83 ESR1 (0.68) ESR1ESR2IGF1RALOX15SLC28A3

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010030787-A1 ESTROGEN RECEPTOR LIGANDS RADIUS HEALTH, INC. (US) 2010-03-18 WO claimed
CN-101278239-B Process for producing substrate with metal wiring NIPPON ZEON CO 2011-11-16 CN disclosed
WO-2010030787-A1 ESTROGEN RECEPTOR LIGANDS RADIUS HEALTH, INC. (US) 2010-03-18 WO disclosed
WO-2010030787-A1 ESTROGEN RECEPTOR LIGANDS RADIUS HEALTH, INC. (US) 2010-03-18 WO disclosed
CN-101278239-A Process for producing substrate with metal wiring ZEON CORP (JP) 2008-10-01 CN disclosed