SCHEMBL21633797

SCHEMBL21633797

CC(C)(C)CC(C)(C)c1ccc(C[O])cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.57
CYP3A4 P08684 5/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
ESR1 P03372 3/20 0.41
ESR2 Q92731 1/20 0.41
MDH1 P40925 6/20 0.37
MDH2 P40926 6/20 0.37
HIF1A Q16665 3/20 0.37
CYP2D6 P10635 2/20 0.37
TP53 P04637 4/20 0.36
TSHR P16473 3/20 0.36
MEN1 O00255 3/20 0.35
USP2 O75604 3/20 0.35
MAPT P10636 3/20 0.35
SLC6A2 P23975 3/20 0.35
SLC6A4 P31645 3/20 0.35
SLC6A3 Q01959 3/20 0.35
KMT2A Q03164 3/20 0.35
KCNH2 Q12809 3/20 0.35
APAF1 O14727 2/20 0.35

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
SCHEMBL21633775 0.80 NPC1 (0.46) SMN1; SMN2ESR1ESR2TP53TSHR
SCHEMBL11543850 0.80 SHBG (0.59) SHBGCYP3A4SMN1; SMN2ESR1ESR2
SCHEMBL29534544 0.78 SHBG (0.57) SHBGCYP3A4SMN1; SMN2ESR1ESR2
SCHEMBL12981475 0.78 SHBG (0.63) SHBGCYP3A4SMN1; SMN2ESR1ESR2
SCHEMBL4580070 0.78 SHBG (0.57) SHBGCYP3A4SMN1; SMN2ESR1ESR2
SCHEMBL200171 0.77 SHBG (0.61) SHBGCYP3A4SMN1; SMN2ESR1ESR2
SCHEMBL10515698 0.77 SHBG (0.67) SHBGCYP3A4SMN1; SMN2ESR1ESR2
SCHEMBL1006929 0.77 TSHR (0.50) TP53TSHRMEN1KMT2AKCNH2
SCHEMBL8355093 0.76 SHBG (0.55) SHBGCYP3A4SMN1; SMN2ESR1ESR2
SCHEMBL8768818 0.75 SHBG (0.64) SHBGCYP3A4SMN1; SMN2ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111315828-B Composition, cured product, optical filter, and method for producing cured product 株式会社艾迪科 2023-09-29 CN disclosed
CN-112154167-B Composition, cured product, optical filter, and method for producing cured product 株式会社艾迪科 2023-08-22 CN disclosed
CN-112154167-A Composition, cured product, optical filter, and method for producing cured product 株式会社艾迪科 2020-12-29 CN disclosed
CN-111315828-A Composition, cured product, optical filter, and method for producing cured product 株式会社艾迪科 2020-06-19 CN disclosed
WO-2020021969-A1 COMPOSITION, CURED PRODUCT, OPTICAL FILTER, AND PRODUCTION METHOD FOR CURED PRODUCT 株式会社ADEKA 2020-01-30 WO disclosed
CN-107132730-A Photosensitive resin composition and application thereof 奇美实业股份有限公司 2017-09-05 CN disclosed