SCHEMBL5953595

SCHEMBL5953595

Oc1ccc(C2(c3ccc(O)c(Cl)c3)CCCCC2)cc1Cl.Oc1ccc(C2(c3ccc(O)cc3)CCCCC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.67
ESR2 Q92731 5/20 0.67
ALDH1A1 P00352 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ACHE P22303 1/20 0.40
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
SLC6A4 P31645 6/20 0.38
SLC6A3 Q01959 6/20 0.38
SLC6A2 P23975 4/20 0.38
HSD11B1 P28845 1/20 0.37
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPT P10636 1/20 0.36
ALOX12 P18054 1/20 0.36
HTT P42858 1/20 0.36
PDE7A Q13946 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36

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
SCHEMBL11420811 1.00 ESR1 (0.67) ESR1ESR2ALDH1A1L3MBTL1ACHE
SCHEMBL10791730 1.00 ESR1 (0.67) ESR1ESR2ALDH1A1L3MBTL1ACHE
SCHEMBL31287152 0.93 ESR1 (0.62) ESR1ESR2ALDH1A1L3MBTL1ACHE
SCHEMBL3305228 0.93 ESR1 (0.62) ESR1ESR2ALDH1A1L3MBTL1ACHE
SCHEMBL68775 0.93 ESR1 (0.62) ESR1ESR2ALDH1A1L3MBTL1ACHE
SCHEMBL29802280 0.93 ESR1 (0.62) ESR1ESR2ALDH1A1L3MBTL1ACHE
SCHEMBL10788082 0.87 ESR1 (0.56) ESR1ESR2ALDH1A1L3MBTL1ACHE
SCHEMBL5524287 0.84 ESR1 (0.74) ESR1ESR2ALDH1A1L3MBTL1ACHE
SCHEMBL21404105 0.84 ESR1 (0.54) ESR1ESR2ALDH1A1L3MBTL1ACHE
SCHEMBL10777847 0.82 ESR2 (1.00) ESR1ESR2ALDH1A1L3MBTL1ACHE

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-7109274-B2 Polyarylate compositions GENERAL ELECTRIC COMPANY (US) 2006-09-19 US claimed