SCHEMBL28804667

SCHEMBL28804667

C=C(C)C(=O)OC1CCCCC1.C=CC(=O)OC1CCCCC1C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.33
EPHX1 P07099 2/20 0.32
NAAA Q02083 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
SCHEMBL23644757 0.87 EPHX1 (0.38) CYP19A1EPHX1NAAA
SCHEMBL6311505 0.87 EPHX1 (0.38) CYP19A1EPHX1NAAA
SCHEMBL23493866 0.85 CYP19A1 (0.41) CYP19A1EPHX1
SCHEMBL904416 0.84 CYP19A1 (0.42) CYP19A1EPHX1
SCHEMBL11762437 0.82 ALDH1A1 (0.33) EPHX1NAAA
SCHEMBL23494225 0.82 CYP19A1 (0.41) CYP19A1EPHX1
Acrylic Acid Methyl Ester SCHEMBL28066990 0.81 EPHX1 (0.39) CYP19A1EPHX1NAAA
SCHEMBL28077597 0.81 EPHX1 (0.40) CYP19A1EPHX1NAAA
SCHEMBL2220504 0.81 CYP19A1 (0.39) CYP19A1EPHX1
SCHEMBL151295 0.81 CYP19A1 (0.42) CYP19A1EPHX1

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
CN-114823748-A Image sensor 采钰科技股份有限公司 2022-07-29 CN disclosed