SCHEMBL5623912

SCHEMBL5623912

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

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 3/20 0.55
TP53 P04637 4/20 0.47
MAPT P10636 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
GAA P10253 1/20 0.45
LMNA P02545 1/20 0.45
THRB P10828 1/20 0.43
CCR9 P51686 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
POLB P06746 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
KCNH2 Q12809 1/20 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
SCHEMBL30601623 1.00 SLC2A1 (0.55) SLC2A1TP53MAPTSMN1; SMN2GAA
SCHEMBL5625320 0.93 TP53 (0.51) SLC2A1TP53MAPTSMN1; SMN2GAA
SCHEMBL14419465 0.90 SLC2A1 (0.53) SLC2A1TP53MAPTSMN1; SMN2GAA
SCHEMBL14419638 0.89 SLC2A1 (0.52) SLC2A1TP53MAPTSMN1; SMN2GAA
SCHEMBL5623951 0.89 SLC2A1 (0.69) SLC2A1TP53MAPTSMN1; SMN2GAA
SCHEMBL14419468 0.88 SLC2A1 (0.53) SLC2A1TP53MAPTSMN1; SMN2GAA
SCHEMBL14419643 0.88 SLC2A1 (0.52) SLC2A1TP53MAPTSMN1; SMN2GAA
SCHEMBL14439959 0.88 SLC2A1 (0.57) SLC2A1TP53MAPTSMN1; SMN2GAA
SCHEMBL14419473 0.88 SLC2A1 (0.60) SLC2A1MAPTGAALMNAALDH1A1
SCHEMBL5623455 0.88 TP53 (0.54) SLC2A1TP53MAPTSMN1; SMN2GAA

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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-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