SCHEMBL10992160

SCHEMBL10992160

CCCCOc1ccc(C(=O)C=O)cc1.[NaH]

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 1/20 0.58
▸ TP53 P04637 1/20 0.58
▸ TSHR P16473 1/20 0.58
▸ PLA2G4B P0C869 5/20 0.57
▸ L3MBTL1 Q9Y468 2/20 0.54
▸ PLK1 P53350 1/20 0.54
▸ RARB P10826 4/20 0.54
▸ MEN1 O00255 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ HPGD P15428 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ GAA P10253 1/20 0.51
▸ PLA2G4A P47712 1/20 0.51

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
SCHEMBL28980597 0.93 TP53 (0.69) ABCG2TP53TSHRPLA2G4BRARB
SCHEMBL28402209 0.93 TP53 (0.69) ABCG2TP53TSHRPLA2G4BRARB
SCHEMBL10990486 0.93 TP53 (0.69) ABCG2TP53TSHRPLA2G4BRARB
Water SCHEMBL7207837 0.92 TP53 (0.67) ABCG2TP53TSHRPLA2G4BRARB
Water SCHEMBL7212248 0.92 TP53 (0.67) ABCG2TP53TSHRPLA2G4BRARB
SCHEMBL10689975 0.91 PLK1 (0.65) ABCG2TP53TSHRPLA2G4BL3MBTL1
SCHEMBL3039297 0.84 PLK1 (0.62) ABCG2PLA2G4BPLK1KMT2A
SCHEMBL27424165 0.83 THRB (0.63) ABCG2TP53TSHRPLA2G4BL3MBTL1
SCHEMBL9786100 0.82 GAA (0.59) ABCG2L3MBTL1PLK1ALDH1A1GAA
SCHEMBL5108830 0.81 L3MBTL1 (0.46) ABCG2L3MBTL1PLK1ALDH1A1GAA

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
US-4536517-A ANTIDIABETIC, ANTILIPEMIC AGENTS AMERICAN CYANAMID COMPANY (US) 1985-08-20 — — US disclosed
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