SCHEMBL29223403

SCHEMBL29223403

CCC(CC1CO1)(CC1CO1)CC1CO1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.37
TDP1 Q9NUW8 2/20 0.35
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL9859861 0.85 ALDH1A1 (0.32) ALDH1A1TSHRMAPK1
SCHEMBL822980 0.82 ALDH1A1 (0.42) ALDH1A1TDP1TSHRMAPK1SMN1; SMN2
SCHEMBL30912786 0.79 ALDH1A1 (0.39) ALDH1A1TDP1TSHRMAPK1SMN1; SMN2
SCHEMBL28199235 0.79 ALDH1A1 (0.50) ALDH1A1TDP1TSHRSMN1; SMN2
SCHEMBL3514633 0.76
SCHEMBL587165 0.74 ALDH1A1 (0.34) ALDH1A1TDP1TSHRMAPK1SMN1; SMN2
SCHEMBL990048 0.74 ALDH1A1 (0.34) ALDH1A1TDP1TSHRMAPK1SMN1; SMN2
SCHEMBL19872892 0.74 ALDH1A1 (0.44) ALDH1A1TDP1TSHRMAPK1SMN1; SMN2
SCHEMBL3235740 0.72
SCHEMBL7124971 0.72 ALDH1A1 (0.33) ALDH1A1TDP1TSHRMAPK1SMN1; SMN2

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
CN-114591218-B (Methyl) acrylic ester monomer containing carbazole structure, and preparation method and application thereof 中国科学院理化技术研究所 2024-05-07 CN disclosed
CN-113490721-B Modified copolyester resin and aqueous dispersion thereof 东洋纺MC株式会社 2024-01-16 CN disclosed
CN-116723940-A Printed matter and laminate DIC株式会社 2023-09-08 CN disclosed
CN-114364754-B Printed matter and laminate DIC株式会社 2023-05-12 CN disclosed