SCHEMBL2605557

SCHEMBL2605557

CC(C1CCCCC1)(C1CCC(c2ccc(O)cc2)(c2ccc(O)cc2)CC1)C1CCC(c2ccc(O)cc2)(c2ccc(O)cc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 8/20 0.55
ESR1 P03372 5/20 0.55
ALDH1A1 P00352 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MIF P14174 1/20 0.34
ADORA3 P0DMS8 1/20 0.34
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
ALOX12 P18054 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
ACHE P22303 1/20 0.32
OPRM1 P35372 1/20 0.32
OPRD1 P41143 1/20 0.32
OPRK1 P41145 1/20 0.32
HSD11B1 P28845 1/20 0.32

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
SCHEMBL9065276 0.90 ESR2 (0.55) ESR2ESR1ALDH1A1L3MBTL1ADORA3
SCHEMBL2498416 0.83 ESR2 (0.53) ESR2ESR1ALDH1A1LMNAMAPT
SCHEMBL45831 0.83 ESR2 (0.53) ESR2ESR1LMNAOPRM1OPRD1
SCHEMBL2605552 0.81 ESR2 (0.52) ESR2ESR1LMNAOPRM1OPRD1
SCHEMBL2605553 0.81 ESR2 (0.49) ESR2ESR1KMT2AOPRM1OPRD1
SCHEMBL2605554 0.79 ESR2 (0.48) ESR2ESR1ALDH1A1LMNAOPRM1
SCHEMBL9353899 0.78 ESR2 (0.60) ESR2ESR1ALDH1A1L3MBTL1MIF
SCHEMBL9065421 0.78 ESR2 (0.64) ESR2ESR1ALDH1A1L3MBTL1KMT2A
SCHEMBL9074041 0.77 ESR2 (0.47) ESR2ESR1ALDH1A1ADORA3MAPT
SCHEMBL20684752 0.77 ESR2 (0.47) ESR2ESR1ALDH1A1MAPTKMT2A

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