SCHEMBL7653909

SCHEMBL7653909

CC(C)(C)c1cc(C(C)(C)c2ccc(O)c(C(C)(C)C)c2)ccc1O.CC(C)(c1ccc(O)c(-c2ccccc2)c1)c1ccc(O)c(-c2ccccc2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.48
CNR2 P34972 3/20 0.48
BACE1 P56817 2/20 0.46
ALDH1A1 P00352 5/20 0.44
ESR1 P03372 4/20 0.44
ALOX15 P16050 3/20 0.44
HSD17B10 Q99714 2/20 0.44
NR1I2 O75469 1/20 0.44
LMNA P02545 1/20 0.44
CYP2C9 P11712 1/20 0.44
MIF P14174 1/20 0.44
TYR P14679 1/20 0.44
HTT P42858 1/20 0.44
NFE2L2 Q16236 1/20 0.44
KLF10 Q13118 1/20 0.44
TSHR P16473 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ESR2 Q92731 3/20 0.41
CYP3A4 P08684 1/20 0.41
HPGD P15428 1/20 0.40

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
SCHEMBL29375340 0.90 BACE1 (0.56) CNR1CNR2BACE1ALDH1A1ESR1
SCHEMBL136305 0.90 BACE1 (0.56) CNR1CNR2BACE1ALDH1A1ESR1
SCHEMBL29602069 0.90 BACE1 (0.56) CNR1CNR2BACE1ALDH1A1ESR1
SCHEMBL13609955 0.89 CNR1 (0.58) CNR1CNR2BACE1ALDH1A1ESR1
SCHEMBL11226795 0.87 CNR1 (0.60) CNR1CNR2BACE1ALDH1A1ESR1
SCHEMBL25404377 0.85 CNR1 (0.59) CNR1CNR2BACE1ALDH1A1ESR1
SCHEMBL7705085 0.85 ESR1 (0.57) CNR1CNR2ALDH1A1ESR1ALOX15
2-Phenylphenol SCHEMBL18240050 0.84 ALDH1A1 (0.53) CNR1CNR2BACE1ALDH1A1ESR1
SCHEMBL7117740 0.84 CNR1 (0.50) CNR1CNR2BACE1ALDH1A1ESR1
SCHEMBL8422985 0.84 ESR1 (0.61) CNR1CNR2BACE1ALDH1A1ESR1

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-20020111456-A1 Method of polycarbonate preparation SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2002-08-15 US claimed
WO-2001085825-A2 METHOD OF POLYCARBONATE PREPARATION GENERAL ELECTRIC COMPANY (US) 2001-11-15 WO claimed