SCHEMBL16256575

SCHEMBL16256575

CCc1ccc(OC)cc1C1=C(O)CC(C)C1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 4/20 0.54
▸ METAP1 P53582 3/20 0.40
▸ POLB P06746 1/20 0.40
▸ CYP24A1 Q07973 2/20 0.39
▸ CYP27A1 Q02318 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ALOX15 P16050 2/20 0.37
▸ ALOX12 P18054 2/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA4 P22748 1/20 0.37
▸ CA7 P43166 1/20 0.37
▸ CA9 Q16790 1/20 0.37
▸ CYP26A1 O43174 1/20 0.37
▸ CYP19A1 P11511 1/20 0.37
▸ CYP3A4 P08684 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ HPGD P15428 2/20 0.37
▸ NPC1 O15118 1/20 0.37

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
SCHEMBL16256583 0.85 METAP1 (0.40) ACHEMETAP1POLBCYP24A1CYP27A1
SCHEMBL16256576 0.83 ACHE (0.56) ACHEMETAP1CYP24A1ALDH1A1KDM4E
SCHEMBL19070544 0.83 ANPEP (0.38) ACHEALDH1A1KDM4EALOX15ALOX12
SCHEMBL16256577 0.80 ACHE (0.52) ACHEMETAP1CYP24A1ALDH1A1KDM4E
SCHEMBL16256586 0.78 CYP24A1 (0.37) ACHEMETAP1CYP24A1CYP27A1CYP26A1
SCHEMBL16256573 0.78 CA1 (0.39) ACHEMETAP1POLBCYP24A1CYP27A1
SCHEMBL16158067 0.77 ME2 (0.53) ACHEALDH1A1NPC1MEN1TP53
SCHEMBL16256580 0.77 CYP24A1 (0.36) ACHEMETAP1CYP24A1CYP27A1ALDH1A1
SCHEMBL16256604 0.75 CYP24A1 (0.40) ACHEMETAP1POLBCYP24A1CYP27A1
SCHEMBL19071282 0.75 METAP1 (0.32) ACHEMETAP1CYP24A1CYP27A1

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-8895474-B2 Herbicidally active cyclopentanediones and derivatives thereof, and their use in controlling weeds SYNGENTA LIMITED (GB) 2014-11-25 — — US disclosed
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