SCHEMBL4410147

SCHEMBL4410147

CC(C)(c1ccc(CC(O)C=O)cc1)c1ccc(CC(O)C=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.51
TP53 P04637 1/20 0.51
ESR1 P03372 4/20 0.39
ESR2 Q92731 4/20 0.39
CYP3A4 P08684 2/20 0.39
AR P10275 2/20 0.39
HPGD P15428 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
HTR6 P50406 1/20 0.39
ESRRG P62508 1/20 0.39
SLC6A3 Q01959 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HTT P42858 1/20 0.34
HIF1A Q16665 1/20 0.34
RECQL P46063 1/20 0.34
ACACB O00763 2/20 0.34

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
SCHEMBL16690513 0.81 TP53 (0.43) TSHRTP53EPHX2GRB2
SCHEMBL8007519 0.78 ESR1 (0.46) TSHRTP53ESR1ESR2CYP3A4
SCHEMBL7980662 0.76 SLC7A5 (0.47) ESR1ESR2CYP3A4SLC6A2MEN1
SCHEMBL17183114 0.76 SLC7A5 (0.47) ESR1ESR2CYP3A4SLC6A2MEN1
SCHEMBL41070 0.76 ESR1 (0.44) TSHRTP53ESR1ESR2CYP3A4
SCHEMBL24320224 0.75 MME (0.44) ACACB
SCHEMBL12226226 0.75 TRPA1 (0.46)
SCHEMBL6603422 0.75 MME (0.44) ACACB
SCHEMBL122782 0.74 EPHX1 (0.50) MEN1KMT2AANPEP
SCHEMBL514290 0.74 EPHX1 (0.50) MEN1KMT2AANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7638053-B2 crosslinked addition-condensation copolymer contains a polyester endcapped with a vinyl polymerized compound such as acrylic acid, methacrylic acid; use in petroleum industry pervaporation technology to reduce energy costs; stability; for separation of aromatic hydrocarbon from aliphatic hydrocarbon GENERAL ELECTRIC COMPANY (US) 2009-12-29 US claimed
US-20060289352-A1 Poly(meth)acrylate membranes for separation of hydrocarbon mixtures BL TECHNOLOGIES, INC. 2006-12-28 US claimed
US-7638053-B2 crosslinked addition-condensation copolymer contains a polyester endcapped with a vinyl polymerized compound such as acrylic acid, methacrylic acid; use in petroleum industry pervaporation technology to reduce energy costs; stability; for separation of aromatic hydrocarbon from aliphatic hydrocarbon GENERAL ELECTRIC COMPANY (US) 2009-12-29 US disclosed
US-20060289352-A1 Poly(meth)acrylate membranes for separation of hydrocarbon mixtures BL TECHNOLOGIES, INC. 2006-12-28 US disclosed