SCHEMBL9854159

SCHEMBL9854159

CCC(C)C(c1ccccc1)=c1ccccc1=C(c1ccccc1)C(C)CC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.44
ADRA2A P08913 1/20 0.44
ADRA2B P18089 1/20 0.44
HTR2A P28223 1/20 0.44
HRH1 P35367 1/20 0.44
KCNH2 Q12809 1/20 0.44
LMNA P02545 4/20 0.40
TRPA1 O75762 2/20 0.40
ALDH1A1 P00352 2/20 0.40
RAB9A P51151 1/20 0.40
ATM Q13315 2/20 0.39
CES2 O00748 2/20 0.38
CES1 P23141 2/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
MAPT P10636 2/20 0.37
HSD17B10 Q99714 1/20 0.37
HPGD P15428 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HKDC1 Q2TB90 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
SCHEMBL9490820 0.79 SMN1; SMN2 (0.39) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL7369308 0.77 LMNA (0.43) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL9491420 0.77 LMNA (0.43) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL4578842 0.76 LMNA (0.41) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL10740235 0.74 ATM (0.43) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL19007619 0.74 LMNA (0.40) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL2128162 0.74 PGR (0.58) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL10410771 0.74 LMNA (0.44) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL27824649 0.74 LMNA (0.40) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL10489465 0.74 PGR (0.58) PGRADRA2AADRA2BHTR2AHRH1

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-0434316-A1 Processes ZENECA LIMITED (GB) 1991-06-26 EP disclosed