SCHEMBL5623913

SCHEMBL5623913

Cc1cc(OCCCS(N)(=O)=O)ccc1NC(=O)COc1ccc(Cl)cc1C(=O)c1cc(F)cc(F)c1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.51
THRB P10828 1/20 0.47
TP53 P04637 4/20 0.46
MAPT P10636 3/20 0.45
GAA P10253 1/20 0.45
ALDH1A1 P00352 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
LMNA P02545 1/20 0.45
KCNH2 Q12809 2/20 0.42
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40

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
SCHEMBL31164670 0.93 SLC2A1 (0.62) SLC2A1SMN1; SMN2THRBTP53MAPT
SCHEMBL5623071 0.93 SLC2A1 (0.62) SLC2A1SMN1; SMN2THRBTP53MAPT
SCHEMBL14419430 0.90 SLC2A1 (0.54) SLC2A1SMN1; SMN2THRBTP53MAPT
SCHEMBL5623608 0.86 SLC2A1 (0.62) SLC2A1SMN1; SMN2THRBTP53MAPT
SCHEMBL5625320 0.85 TP53 (0.51) SLC2A1SMN1; SMN2THRBTP53MAPT
SCHEMBL5623832 0.84 SLC2A1 (0.61) SLC2A1SMN1; SMN2THRBTP53MAPT
SCHEMBL5624748 0.84 SLC2A1 (0.77) SLC2A1SMN1; SMN2THRBTP53MAPT
SCHEMBL5626228 0.84 TP53 (0.50) SLC2A1SMN1; SMN2THRBTP53MAPT
SCHEMBL5623446 0.81 PTGDR2 (0.47) SLC2A1SMN1; SMN2THRBTP53MAPT
SCHEMBL14419446 0.80 MAPT (0.59) SMN1; SMN2THRBTP53MAPTGAA

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 11 patents. 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 claimed
EP-1710238-A1 Benzophenones as inhibitors of reverse transcriptase GLAXO GROUP LIMITED (GB) 2006-10-11 EP claimed
CN-1391565-A Benzophenones as reverse transcriptase inhibitors GLAXO GROUP LTD (GB) 2003-01-15 CN claimed
EP-1208091-A1 BENZOPHENONES AS INHIBITORS OF REVERSE TRANSCRIPTASE GLAXO GROUP LIMITED (GB) 2002-05-29 EP claimed
WO-2001017982-A1 BENZOPHENONES AS INHIBITORS OF REVERSE TRANSCRIPTASE GLAXO GROUP LIMITED (GB) 2001-03-15 WO claimed
US-7273863-B1 Benzophenones as inhibitors of reverse transcriptase SMITHKLINE BEECHAM CORPORATION (US) 2007-09-25 US disclosed
US-7273863-B1 Benzophenones as inhibitors of reverse transcriptase SMITHKLINE BEECHAM CORPORATION (US) 2007-09-25 US disclosed
EP-1710238-A1 Benzophenones as inhibitors of reverse transcriptase GLAXO GROUP LIMITED (GB) 2006-10-11 EP disclosed
CN-1391565-A Benzophenones as reverse transcriptase inhibitors GLAXO GROUP LTD (GB) 2003-01-15 CN disclosed
EP-1208091-A1 BENZOPHENONES AS INHIBITORS OF REVERSE TRANSCRIPTASE GLAXO GROUP LIMITED (GB) 2002-05-29 EP disclosed
WO-2001017982-A1 BENZOPHENONES AS INHIBITORS OF REVERSE TRANSCRIPTASE GLAXO GROUP LIMITED (GB) 2001-03-15 WO disclosed