SCHEMBL14419231

SCHEMBL14419231

CCOC(=O)COc1ccc(Cl)cc1C(=O)c1cc(F)cc(F)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ MAPT P10636 2/20 0.46
▸ GAA P10253 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ LMNA P02545 1/20 0.45
▸ PTGDR2 Q9Y5Y4 2/20 0.45
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ HIF1A Q16665 1/20 0.43
▸ HPGD P15428 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ CASP1 P29466 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42

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
SCHEMBL14419295 0.91 MAPT (0.50) ALDH1A1TDP1L3MBTL1MAPTGAA
SCHEMBL14419279 0.90 MAPT (0.47) ALDH1A1TDP1L3MBTL1MAPTGAA
SCHEMBL14419576 0.90 SLC2A1 (0.45) ALDH1A1TDP1L3MBTL1MAPTGAA
SCHEMBL14419306 0.89 ALDH1A1 (0.50) ALDH1A1TDP1L3MBTL1MAPTGAA
SCHEMBL14419300 0.87 MAPT (0.47) ALDH1A1TDP1L3MBTL1MAPTGAA
SCHEMBL14419477 0.86 MAPT (0.50) ALDH1A1TDP1L3MBTL1MAPTGAA
SCHEMBL14419325 0.85 HPGD (0.58) ALDH1A1TDP1L3MBTL1MAPTGAA
SCHEMBL14419423 0.85 GAA (0.46) ALDH1A1TDP1L3MBTL1MAPTGAA
SCHEMBL14419282 0.84 MAPT (0.48) ALDH1A1TDP1L3MBTL1MAPTGAA
SCHEMBL14419692 0.84 PTGDR2 (0.50) ALDH1A1TDP1L3MBTL1MAPTGAA

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-7273863-B1 Benzophenones as inhibitors of reverse transcriptase SMITHKLINE BEECHAM CORPORATION (US) 2007-09-25 — — US disclosed
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