SCHEMBL30146579

SCHEMBL30146579

CC(=O)NC1CCC(COC(C)=O)OC1OCCOCCOCCN=[N+]=[N-]

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ BDNF P23560 3/20 0.32
▸ PTN P21246 2/20 0.32
▸ MDK P21741 2/20 0.32
▸ CYP3A4 P08684 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31

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
SCHEMBL13785433 0.81 CYP3A4 (0.37) BDNFPTNMDKCYP3A4MAPT
SCHEMBL26192483 0.76 CYP3A4 (0.41) BDNFPTNMDKCYP3A4MAPT
SCHEMBL16299280 0.76 — —
SCHEMBL29330035 0.76 CYP3A4 (0.41) BDNFPTNMDKCYP3A4MAPT
SCHEMBL14725531 0.76 CYP3A4 (0.41) BDNFPTNMDKCYP3A4MAPT
SCHEMBL25468082 0.76 CYP3A4 (0.41) BDNFPTNMDKCYP3A4MAPT
SCHEMBL15527659 0.76 CYP3A4 (0.33) BDNFPTNMDKCYP3A4MAPT
SCHEMBL14352658 0.76 CYP3A4 (0.33) BDNFPTNMDKCYP3A4MAPT
SCHEMBL18837333 0.75 CYP3A4 (0.56) BDNFPTNMDKCYP3A4MAPT
SCHEMBL17297174 0.75 CYP3A4 (0.56) BDNFPTNMDKCYP3A4MAPT

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
WO-2022270941-A1 LIPID NANOPARTICLES AND METHOD FOR PREPARING SAME 주식회사 테르나테라퓨틱스 2022-12-29 — — WO disclosed
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