SCHEMBL1473043

SCHEMBL1473043

C=CCOc1c2cc(CC=C)cc1Cc1cc(CC=C)cc(c1OCC=C)Cc1cc(CC=C)cc(c1OCC=C)Cc1cc(CC=C)cc(c1OCC=C)C2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
TNKS O95271 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
ALDH1A1 P00352 5/20 0.33
CYP3A4 P08684 4/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
PPARG P37231 2/20 0.33
PPARD Q03181 2/20 0.33
HSD17B10 Q99714 1/20 0.33
PPARA Q07869 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 2/20 0.33
CYP1A2 P05177 1/20 0.33
XDH P47989 1/20 0.32
TP53 P04637 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
ALOX12 P18054 1/20 0.32

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
SCHEMBL1398342 0.79 HSD17B10 (0.37) ADRA2AADRA2BADRA2CALDH1A1SMN1; SMN2
SCHEMBL9253029 0.79 ALDH1A1 (0.36) ALDH1A1CYP3A4SMN1; SMN2PPARGPPARD
SCHEMBL5082696 0.76 FFAR4 (0.40) TNKSTNKS2ALDH1A1CYP3A4SMN1; SMN2
SCHEMBL1473328 0.75 CD69 (0.48) ADRA2AADRA2BADRA2CCYP3A4HSD17B10
SCHEMBL1471513 0.72 PTPRB (0.47) TNKSTNKS2ALDH1A1CYP3A4PPARG
SCHEMBL20226270 0.68 GABRA1 (0.44) CYP3A4HSD17B10MAPTALOX15MEN1
SCHEMBL2108268 0.68 CD69 (0.44) ADRA2AADRA2BADRA2CALDH1A1CYP3A4
SCHEMBL215399 0.67 XDH (0.50) TNKSTNKS2ALDH1A1CYP3A4SMN1; SMN2
SCHEMBL22701030 0.66 ALDH1A1 (0.39) ADRA2AADRA2BADRA2CALDH1A1CYP3A4
SCHEMBL7782792 0.64 ALDH1A1 (0.61) ADRA2AADRA2BADRA2CALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7915438-B1 Solid phase host compositions NORTHWESTERN UNIVERSITY (US) 2011-03-29 US disclosed
US-7271259-B1 Solid phase host compositions NORTHWESTERN UNIVERSITY (US) 2007-09-18 US disclosed