SCHEMBL28972733

SCHEMBL28972733

COC(CCC(=O)C(C)(C)C)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 4/20 0.32
CYP1A2 P05177 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
SCHEMBL8080753 0.79 CYP1A2 (0.50) FOLH1CYP1A2
SCHEMBL6789915 0.78 SLC1A3 (0.39) CYP1A2
SCHEMBL6787830 0.78 SLC1A3 (0.39) CYP1A2
SCHEMBL28972743 0.77 MEN1 (0.38) FOLH1
SCHEMBL25773634 0.77 ALDH1A1 (0.39) FOLH1CYP1A2
SCHEMBL21848005 0.75 ALDH1A1 (0.41) FOLH1CYP1A2
SCHEMBL6789204 0.73 HDAC2 (0.39)
SCHEMBL18214314 0.72 CYP1A2 (0.60) FOLH1CYP1A2
SCHEMBL16229994 0.72
SCHEMBL25516 0.72

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
CN-115677491-A Preparation process of ethyl 4- (ethoxycarbonyl) methoxybutyrate 武汉市振邦生物科技有限公司 2023-02-03 CN claimed
CN-115677491-A Preparation process of ethyl 4- (ethoxycarbonyl) methoxybutyrate 武汉市振邦生物科技有限公司 2023-02-03 CN disclosed