SCHEMBL6911548

SCHEMBL6911548

CCCCCC(C)C(C)c1ccc(O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 8/20 0.44
ADORA3 P0DMS8 3/20 0.44
SLC6A2 P23975 3/20 0.44
SLC6A3 Q01959 3/20 0.44
ADRA2A P08913 2/20 0.44
TACR2 P21452 2/20 0.44
SLC6A4 P31645 2/20 0.44
LMNA P02545 2/20 0.44
CYP3A4 P08684 2/20 0.44
CHRM2 P08172 2/20 0.44
CHRM1 P11229 2/20 0.44
PTGS1 P23219 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
SHBG P04278 1/20 0.44
TP53 P04637 1/20 0.44
HSPD1 P10809 1/20 0.44
ADRB3 P13945 1/20 0.44
HTR2C P28335 1/20 0.44
HSPE1 P61604 1/20 0.44

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
SCHEMBL3239007 0.94 ESR1 (0.45) ESR1ADORA3SLC6A2SLC6A3ADRA2A
SCHEMBL5699301 0.82 NR5A1 (0.47) ESR1ADORA3SLC6A2SLC6A3ADRA2A
SCHEMBL68774 0.81 ADRB2 (0.54) CYP3A4HIF1APTGS2ADRA1AADRB2
SCHEMBL6686936 0.81 ESR1 (0.52) ESR1ADORA3SLC6A2SLC6A3ADRA2A
SCHEMBL11831177 0.80 ADRB2 (0.53) CYP3A4HIF1APTGS2ADRA1AADRB2
SCHEMBL2953489 0.80 ADRB2 (0.53) CYP3A4HIF1APTGS2ADRA1AADRB2
SCHEMBL11828601 0.80 ADRB2 (0.53) CYP3A4HIF1APTGS2ADRA1AADRB2
SCHEMBL22562968 0.80 RARB (0.47) ALDH1A1TP53MAPT
SCHEMBL21274215 0.80 OPRM1 (0.47) SLC6A3ADRA2ALMNAKDM4EADRB3
SCHEMBL25172266 0.79 ESR1 (0.50) ESR1ADORA3SLC6A2SLC6A3ADRA2A

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-1460090-A1 PROCESSES FOR PRODUCTION OF POWDERED FLUORORESINS BEARING CURABLE FUNCTIONAL GROUPS AND COATING COMPOSITIONS CONTAINING THE SAME Asahi Glass Company, Limited (JP) 2004-09-22 EP disclosed