SCHEMBL14419576

SCHEMBL14419576

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

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 3/20 0.45
▸ ALDH1A1 P00352 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ MAPT P10636 2/20 0.41
▸ THRB P10828 1/20 0.41
▸ PTGDR2 Q9Y5Y4 2/20 0.40
▸ MRGPRX4 Q96LA9 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ VNN1 O95497 1/20 0.38

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
SCHEMBL14419687 0.90 SLC2A1 (0.46) SLC2A1ALDH1A1TDP1L3MBTL1MAPT
SCHEMBL13743326 0.90 MRGPRX4 (0.44) SLC2A1MAPTPTGDR2MRGPRX4LMNA
SCHEMBL14419231 0.90 ALDH1A1 (0.47) ALDH1A1TDP1L3MBTL1MAPTTHRB
SCHEMBL12328443 0.86 PTGDR2 (0.54) SLC2A1TDP1MAPTPTGDR2MRGPRX4
SCHEMBL14419295 0.83 MAPT (0.50) ALDH1A1TDP1L3MBTL1MAPTTHRB
SCHEMBL14419279 0.82 MAPT (0.47) ALDH1A1TDP1L3MBTL1MAPTTHRB
SCHEMBL12328442 0.82 POLB (0.49) MAPTMRGPRX4LMNA
SCHEMBL14419306 0.81 ALDH1A1 (0.50) ALDH1A1TDP1L3MBTL1MAPTTHRB
SCHEMBL14419300 0.80 MAPT (0.47) ALDH1A1TDP1L3MBTL1MAPTTHRB
SCHEMBL14419477 0.79 MAPT (0.50) ALDH1A1TDP1L3MBTL1MAPTTHRB

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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