SCHEMBL23633732

SCHEMBL23633732

C=C(C)C(=O)OC1CC2CC1C(C)C2(C)C

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
CYP19A1 P11511 5/20 0.30
CYP17A1 P05093 2/20 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
SCHEMBL23633725 0.78 CYP19A1 (0.30) CYP19A1CYP17A1
SCHEMBL4598002 0.78 CYP19A1 (0.49) CYP19A1CYP17A1
SCHEMBL17213209 0.78 CYP19A1 (0.49) CYP19A1CYP17A1
SCHEMBL23633752 0.74
SCHEMBL23633753 0.74
SCHEMBL3060954 0.73 ALDH1A1 (0.44) ALDH1A1
SCHEMBL13486938 0.73 RET (0.32) ALDH1A1CYP19A1CYP17A1
SCHEMBL18513493 0.73 ALDH1A1 (0.31) ALDH1A1
SCHEMBL20349637 0.73 CYP19A1 (0.39) CYP19A1CYP17A1
SCHEMBL23633730 0.72 ALDH1A1 (0.31) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11059923-B2 Preparation method for high-solid acrylic resin WUXI ACRYL TECHNOLOGY CO., LTD (CN) 2021-07-13 US disclosed