SCHEMBL30956255

SCHEMBL30956255

CCN(CC)c1ccc2c(OC)cc(=O)oc2c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 11/20 0.68
▸ GLA P06280 8/20 0.68
▸ L3MBTL1 Q9Y468 7/20 0.68
▸ IGLV6-57 P01721 6/20 0.68
▸ HPGD P15428 5/20 0.68
▸ CYP3A4 P08684 5/20 0.68
▸ HSD17B10 Q99714 5/20 0.68
▸ ATM Q13315 5/20 0.68
▸ CASP1 P29466 4/20 0.68
▸ CASP7 P55210 4/20 0.68
▸ MAPK1 P28482 2/20 0.68
▸ HIF1A Q16665 1/20 0.68
▸ KDM4E B2RXH2 8/20 0.66
▸ MEN1 O00255 5/20 0.66
▸ KMT2A Q03164 5/20 0.66
▸ MAPT P10636 5/20 0.66
▸ TDP1 Q9NUW8 4/20 0.66
▸ CYP1A2 P05177 3/20 0.66
▸ CYP2C19 P33261 3/20 0.66
▸ CYP2C9 P11712 2/20 0.66

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
SCHEMBL29362472 0.81 ALDH1A1 (1.00) ALDH1A1GLAL3MBTL1IGLV6-57HPGD
SCHEMBL67108 0.81 ALDH1A1 (1.00) ALDH1A1GLAL3MBTL1IGLV6-57HPGD
SCHEMBL384286 0.81 ALDH1A1 (1.00) ALDH1A1GLAL3MBTL1IGLV6-57HPGD
SCHEMBL6690441 0.81 ALDH1A1 (0.73) ALDH1A1GLAL3MBTL1IGLV6-57HPGD
SCHEMBL24531786 0.80 ALDH1A1 (0.58) ALDH1A1GLAL3MBTL1IGLV6-57HPGD
SCHEMBL5964617 0.79 ALDH1A1 (0.71) ALDH1A1GLAL3MBTL1IGLV6-57HPGD
SCHEMBL1942067 0.79 ALDH1A1 (1.00) ALDH1A1GLAL3MBTL1IGLV6-57HPGD
SCHEMBL12651810 0.79 ALDH1A1 (1.00) ALDH1A1GLAL3MBTL1IGLV6-57HPGD
SCHEMBL29593308 0.79 ALDH1A1 (1.00) ALDH1A1GLAL3MBTL1IGLV6-57HPGD
SCHEMBL20420737 0.79 ALDH1A1 (0.71) ALDH1A1GLAL3MBTL1IGLV6-57HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118190890-B Complex detection method 山东成武易信环保科技有限公司 2025-02-11 — — CN claimed
CN-118190890-A Complex detection method 山东成武易信环保科技有限公司 2024-06-14 — — CN claimed
CN-118190890-B Complex detection method 山东成武易信环保科技有限公司 2025-02-11 — — CN disclosed
CN-118190890-A Complex detection method 山东成武易信环保科技有限公司 2024-06-14 — — CN disclosed
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