SCHEMBL2605550

SCHEMBL2605550

CC(C)(c1cc(C(C)(C)C2CCC(c3ccc(O)cc3)(c3ccc(O)cc3)CC2)cc(C(C)(C)C2CCC(c3ccc(O)cc3)(c3ccc(O)cc3)CC2)c1)C1CCC(c2ccc(O)cc2)(c2ccc(O)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 12/20 0.47
ESR1 P03372 9/20 0.47
CYP3A4 P08684 2/20 0.34
LMNA P02545 1/20 0.34
TYR P14679 1/20 0.34
AR P10275 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
HTR6 P50406 1/20 0.34
ESRRG P62508 1/20 0.34
SLC6A3 Q01959 1/20 0.34
HSD17B10 Q99714 1/20 0.34
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
OPRK1 P41145 1/20 0.34
HSD11B1 P28845 1/20 0.32
ALDH1A1 P00352 1/20 0.31
GABRA1 P14867 1/20 0.31

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
SCHEMBL12606716 0.92 ESR2 (0.44) ESR2ESR1CYP3A4LMNATYR
SCHEMBL2605554 0.92 ESR2 (0.48) ESR2ESR1CYP3A4LMNATYR
SCHEMBL9065614 0.88 ESR2 (0.44) ESR2ESR1CYP3A4LMNATYR
SCHEMBL2605551 0.86 ESR2 (0.43) ESR2ESR1CYP3A4LMNATYR
SCHEMBL45831 0.83 ESR2 (0.53) ESR2ESR1CYP3A4LMNATYR
SCHEMBL2498416 0.83 ESR2 (0.53) ESR2ESR1CYP3A4LMNATYR
SCHEMBL2605552 0.81 ESR2 (0.52) ESR2ESR1CYP3A4LMNATYR
SCHEMBL2855402 0.77 ESR2 (0.38) ESR2ESR1CYP3A4LMNATYR
SCHEMBL20684752 0.77 ESR2 (0.47) ESR2ESR1CYP3A4OPRM1OPRD1
SCHEMBL9074041 0.77 ESR2 (0.47) ESR2ESR1ALDH1A1

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-8158324-B2 Positive-type photosensitive resin composition TORAY INDUSTRIES, INC. (JP) 2012-04-17 US disclosed
US-8158324-B2 Positive-type photosensitive resin composition TORAY INDUSTRIES, INC. (JP) 2012-04-17 US disclosed
US-20100099041-A1 POSITIVE-TYPE PHOTOSENSITIVE RESIN COMPOSITION TORAY INDUSTRIES, INC. (JP) 2010-04-22 US disclosed
US-20100099041-A1 POSITIVE-TYPE PHOTOSENSITIVE RESIN COMPOSITION TORAY INDUSTRIES, INC. (JP) 2010-04-22 US disclosed