SCHEMBL23241908

SCHEMBL23241908

CC(C)C1CCC(c2ccc(O)c(C3CCCCC3)c2)(c2ccc(O)c(C3CCCCC3)c2)CC1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.45
ESR1 P03372 4/20 0.43
ESR2 Q92731 4/20 0.43
NUDT1 P36639 1/20 0.42
BACE1 P56817 1/20 0.42
THRB P10828 1/20 0.33
ACMSD Q8TDX5 2/20 0.32
PTGDR2 Q9Y5Y4 2/20 0.32
PTGDR Q13258 1/20 0.32
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
OPRK1 P41145 1/20 0.31
OPRL1 P41146 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
ACHE P22303 1/20 0.30

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
SCHEMBL17636607 0.86 NUDT1 (0.42) HSP90AA1ESR1ESR2NUDT1BACE1
SCHEMBL20225257 0.84 ESR1 (0.56) HSP90AA1ESR1ESR2NUDT1BACE1
SCHEMBL10595392 0.84 ESR1 (0.56) HSP90AA1ESR1ESR2NUDT1BACE1
SCHEMBL5881414 0.84 ESR1 (0.56) HSP90AA1ESR1ESR2NUDT1BACE1
SCHEMBL3021025 0.84 ESR1 (0.56) HSP90AA1ESR1ESR2NUDT1BACE1
SCHEMBL278620 0.84 ESR1 (0.56) HSP90AA1ESR1ESR2NUDT1BACE1
SCHEMBL9008331 0.84 ESR1 (0.56) HSP90AA1ESR1ESR2NUDT1BACE1
SCHEMBL29401448 0.84 ESR1 (0.56) HSP90AA1ESR1ESR2NUDT1BACE1
SCHEMBL17636603 0.81 HSP90AA1 (0.45) HSP90AA1ESR1ESR2NUDT1BACE1
SCHEMBL10941119 0.79 ESR2 (0.59) HSP90AA1ESR1ESR2NUDT1BACE1

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-11789363-B2 Positive photosensitive resin composition, cured film therefrom, and solid state image sensor comprising the same TORAY INDUSTRIES, INC. (JP) 2023-10-17 US disclosed
US-20210116812-A1 POSITIVE PHOTOSENSITIVE RESIN COMPOSITION, CURED FILM THEREFROM, AND SOLID STATE IMAGE SENSOR COMPRISING THE SAME TORAY INDUSTRIES, INC. (JP) 2021-04-22 US disclosed