SCHEMBL5623071

SCHEMBL5623071

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

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 3/20 0.62
SMN1; SMN2 Q16637 2/20 0.47
THRB P10828 1/20 0.42
TP53 P04637 4/20 0.42
MAPT P10636 2/20 0.41
GAA P10253 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
LMNA P02545 1/20 0.41
KCNH2 Q12809 2/20 0.39
NPSR1 Q6W5P4 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
MAOB P27338 1/20 0.37
CA5A P35218 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
SCHEMBL31164670 1.00 SLC2A1 (0.62) SLC2A1SMN1; SMN2THRBTP53MAPT
SCHEMBL5623913 0.93 SLC2A1 (0.56) SLC2A1SMN1; SMN2THRBTP53MAPT
SCHEMBL5623608 0.93 SLC2A1 (0.62) SLC2A1SMN1; SMN2THRBTP53MAPT
SCHEMBL5623832 0.91 SLC2A1 (0.61) SLC2A1SMN1; SMN2THRBTP53MAPT
SCHEMBL30601623 0.87 SLC2A1 (0.55) SLC2A1SMN1; SMN2THRBTP53MAPT
SCHEMBL5623912 0.87 SLC2A1 (0.55) SLC2A1SMN1; SMN2THRBTP53MAPT
SCHEMBL14439960 0.86 SLC2A1 (0.61) SLC2A1SMN1; SMN2THRBTP53MAPT
SCHEMBL14459452 0.85 SLC2A1 (0.60) SLC2A1SMN1; SMN2THRBTP53MAPT
SCHEMBL14419430 0.85 SLC2A1 (0.54) SLC2A1SMN1; SMN2THRBTP53MAPT
SCHEMBL12328444 0.85 SLC2A1 (0.56) SLC2A1SMN1; SMN2THRBTP53MAPT

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 6 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
US-7462608-B2 Non nucleoside reverse transcriptase inhibitors GILEAD SCIENCES, INC. (US) 2008-12-09 US disclosed
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