SCHEMBL25022395

SCHEMBL25022395

Cc1ccc(C(C2CCC2)C(C)OC(=O)CN)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ POLB P06746 1/20 0.34
▸ BCHE P06276 1/20 0.33
▸ ACHE P22303 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ RAB9A P51151 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
SCHEMBL25021455 0.98 LMNA (0.41) HPGDLMNAL3MBTL1ALDH1A1KDM4E
SCHEMBL25022706 0.96 LMNA (0.40) HPGDLMNAL3MBTL1ALDH1A1KDM4E
SCHEMBL25021573 0.87 LMNA (0.42) HPGDLMNAL3MBTL1ALDH1A1KDM4E
SCHEMBL20348355 0.84 LMNA (0.37) HPGDLMNAL3MBTL1ALDH1A1KDM4E
SCHEMBL20348340 0.82 LMNA (0.39) HPGDLMNAL3MBTL1ALDH1A1KDM4E
SCHEMBL20348337 0.81 LMNA (0.39) HPGDLMNAALDH1A1KDM4EPOLB
SCHEMBL25022263 0.81 HPGD (0.38) HPGDLMNAL3MBTL1ALDH1A1KDM4E
SCHEMBL25021356 0.79 HPGD (0.38) HPGDLMNAL3MBTL1ALDH1A1KDM4E
SCHEMBL25021314 0.78 EPHX1 (0.38) HPGDLMNAL3MBTL1ALDH1A1KDM4E
SCHEMBL25021450 0.78 HPGD (0.36) HPGDLMNAL3MBTL1POLBBCHE

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
EP-3565410-B1 PICOLINAMIDES AS FUNGICIDES CORTEVA AGRISCIENCE LLC (US) 2023-02-15 — — EP disclosed
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