SCHEMBL7363720

SCHEMBL7363720

CCOc1ccccc1S(=O)(=O)N(c1cc(C)cc(OCC#N)c1)C(C)(C)P(=O)=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 3/20 0.34
KAT6A Q92794 3/20 0.34
NPC1 O15118 1/20 0.32
AR P10275 1/20 0.31
ALDH1A1 P00352 3/20 0.31
POLB P06746 2/20 0.31
TP53 P04637 1/20 0.31
BRD4 O60885 1/20 0.31
PRSS2 P07478 1/20 0.30
CTRC Q99895 1/20 0.30
MAPT P10636 2/20 0.30
TRPV4 Q9HBA0 1/20 0.30
TSHR P16473 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
ALPL P05186 1/20 0.30
MAPK1 P28482 1/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL7359257 0.93 F2 (0.35) F2
SCHEMBL7479980 0.92 F2 (0.34) F2
SCHEMBL8728793 0.91 F2 (0.41) F2ARALDH1A1MAPTTRPV4
SCHEMBL7357199 0.89 BRPF1 (0.34) F2KAT6A
SCHEMBL8729631 0.86 F2 (0.40) F2KAT6ANPC1PRSS2CTRC
SCHEMBL7359565 0.79 F2 (0.39) F2KAT6APRSS2CTRC
SCHEMBL8726659 0.79 F2 (0.58) F2POLBPRSS2CTRC
SCHEMBL7537667 0.79 F2 (0.39) F2PRSS2CTRC
SCHEMBL7538371 0.78 BRD4 (0.38) ALDH1A1BRD4MAPTTSHRL3MBTL1
SCHEMBL7360906 0.77 F2 (0.47) F2PRSS2CTRCTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5824679-A Phosphanoxides--preparation and use BOEHRINGER MANNHEIM GMBH (DE) 1998-10-20 US disclosed
EP-0778839-A1 NOVEL PHOSPHANE OXIDES, METHOD OF PREPARING THEM AND DRUGS CONTAINING THESE COMPOUNDS Roche Diagnostics GmbH (DE) 1997-06-18 EP disclosed
WO-1996006849-A1 NOVEL PHOSPHANE OXIDES, METHOD OF PREPARING THEM AND DRUGS CONTAINING THESE COMPOUNDS BOEHRINGER MANNHEIM GMBH (DE) 1996-03-07 WO disclosed