SCHEMBL9269593

SCHEMBL9269593

COC(=O)c1ccc(C(C(=O)O)c2ccc(C(=O)O)c(C(=O)OC)c2)cc1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 4/20 0.51
▸ CA1 P00915 4/20 0.51
▸ CA2 P00918 4/20 0.51
▸ CA7 P43166 4/20 0.51
▸ CA9 Q16790 4/20 0.51
▸ CA14 Q9ULX7 4/20 0.51
▸ PDK2 Q15119 1/20 0.51
▸ PDK4 Q16654 1/20 0.51
▸ GAA P10253 2/20 0.49
▸ HSD17B10 Q99714 6/20 0.48
▸ ALDH1A1 P00352 6/20 0.48
▸ KDM4E B2RXH2 5/20 0.48
▸ HPGD P15428 5/20 0.48
▸ TDP1 Q9NUW8 4/20 0.48
▸ GRM1 Q13255 3/20 0.48
▸ MEN1 O00255 3/20 0.48
▸ CYP2C9 P11712 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ GRM2 Q14416 2/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL9418714 0.83 ALDH1A1 (0.62) CA12CA1CA2CA7CA9
SCHEMBL9269604 0.79 HSD17B10 (0.46) CA12CA1CA2CA7CA9
SCHEMBL13073464 0.78 HSD17B10 (0.69) CA12CA1CA2CA7CA9
SCHEMBL20240086 0.78 HSD17B10 (0.66) CA12CA1CA2CA7CA9
SCHEMBL3164267 0.77 CA12 (0.62) CA12CA1CA2CA7CA9
SCHEMBL9269600 0.76 HSD17B10 (0.47) CA12CA1CA2CA7CA9
SCHEMBL19273251 0.74 CA12 (0.59) CA12CA1CA2CA7CA9
SCHEMBL27558985 0.73 CA12 (0.67) CA12CA1CA2CA7CA9
SCHEMBL21366578 0.73 CA12 (0.57) CA12CA1CA2CA7CA9
SCHEMBL3550245 0.72 CA12 (0.53) CA12CA1CA2CA7CA9

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
US-5378799-A Heat-stable polyimides and polyamide-imides with modified benzhydrol structural elements and their preparation CHEMIE LINZ GMBH (AT) 1995-01-03 — — US claimed
US-5378799-A Heat-stable polyimides and polyamide-imides with modified benzhydrol structural elements and their preparation CHEMIE LINZ GMBH (AT) 1995-01-03 — — US disclosed
US-5378799-A Heat-stable polyimides and polyamide-imides with modified benzhydrol structural elements and their preparation CHEMIE LINZ GMBH (AT) 1995-01-03 — — US disclosed
US-4851506-A Photostructurable polyimide mixtures CIBA-GEIGY CORPORATION (US) 1989-07-25 — — US disclosed
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