SCHEMBL7532791

SCHEMBL7532791

O=C(Nc1ccc(C(F)(F)F)cc1)c1sccc1NS(=O)(=O)c1ccc(F)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
RAB9A P51151 1/20 0.49
KMT2A Q03164 1/20 0.49
GPR27 Q9NS67 4/20 0.48
MAPT P10636 4/20 0.48
LMNA P02545 3/20 0.48
TP53 P04637 2/20 0.48
SERPINE1 P05121 1/20 0.46
TRPV4 Q9HBA0 1/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
S1PR2 O95136 1/20 0.44
PARP14 Q460N5 1/20 0.44
MAPK1 P28482 1/20 0.44
AVPR2 P30518 3/20 0.44
SLC20A2 Q08357 1/20 0.44
SLC20A1 Q8WUM9 1/20 0.44
ACLY P53396 1/20 0.43

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
SCHEMBL7530740 0.89 MEN1 (0.50) MEN1KMT2AGPR27MAPTLMNA
SCHEMBL7537385 0.88 ACLY (0.51) MEN1RAB9AKMT2AGPR27MAPT
SCHEMBL7535071 0.87 LMNA (0.47) MEN1RAB9AKMT2AGPR27MAPT
SCHEMBL7539041 0.85 MEN1 (0.53) MEN1RAB9AKMT2AGPR27TRPV4
SCHEMBL7531850 0.85 ACLY (0.46) MEN1RAB9AKMT2AMAPTLMNA
SCHEMBL7531761 0.83 MAPT (0.49) MEN1KMT2AGPR27MAPTLMNA
SCHEMBL7531372 0.82 SLC10A2 (0.48) MEN1RAB9AKMT2AGPR27MAPT
SCHEMBL7530790 0.82 SLC20A2 (0.65) MEN1RAB9AKMT2AGPR27MAPT
SCHEMBL7531845 0.81 HTT (0.47) MEN1RAB9AKMT2AGPR27MAPT
SCHEMBL7534822 0.81 HTT (0.51) MEN1RAB9AKMT2AGPR27MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002028353-A2 PHOSPHATE TRANSPORT INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2002-04-11 WO claimed
WO-2002028353-A2 PHOSPHATE TRANSPORT INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2002-04-11 WO disclosed