SCHEMBL2055448

SCHEMBL2055448

CCOP(=O)(CN(c1ccc2cc(NC(=O)Nc3ccccc3)ccc2c1)S(=O)(=O)c1cc(Cl)cc(Cl)c1)OCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.42
TP53 P04637 2/20 0.42
THRB P10828 2/20 0.42
RAB9A P51151 4/20 0.41
NPC1 O15118 3/20 0.41
MEN1 O00255 6/20 0.41
KMT2A Q03164 6/20 0.41
NOX1 Q9Y5S8 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HTT P42858 2/20 0.40
POLB P06746 1/20 0.39
LMNA P02545 4/20 0.39
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CA2 P00918 1/20 0.39

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
SCHEMBL2055453 0.89 NPC1 (0.43) MAPTTP53THRBRAB9ANPC1
SCHEMBL1754307 0.87 MAPT (0.46) MAPTTP53RAB9ANPC1MEN1
SCHEMBL2055339 0.85 KAT6A (0.40) MAPTTP53THRBRAB9AMEN1
SCHEMBL3033318 0.80 PTPN11 (0.46) TP53RAB9ANPC1POLBLMNA
SCHEMBL2055353 0.80 MAPT (0.38) MAPTTP53THRBRAB9ANPC1
SCHEMBL2055449 0.80 S1PR1 (0.35) MAPTLMNA
SCHEMBL2097965 0.78 MAPT (0.42) MAPTTP53RAB9ANPC1MEN1
SCHEMBL2055363 0.77 CYP3A4 (0.38) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL2055361 0.77 PLK1 (0.37) THRBSMN1; SMN2L3MBTL1
SCHEMBL2055359 0.76 MEN1 (0.38) MAPTTP53THRBMEN1KMT2A

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-8163911-B2 Arylsulfonylaminomethylphosphonic acid derivatives, the preparation thereof and the use thereof as pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-04-24 US disclosed
US-8163911-B2 Arylsulfonylaminomethylphosphonic acid derivatives, the preparation thereof and the use thereof as pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-04-24 US disclosed
US-8163911-B2 Arylsulfonylaminomethylphosphonic acid derivatives, the preparation thereof and the use thereof as pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-04-24 US disclosed
US-20100261677-A1 ARYLSULFONYLAMINOMETHYLPHOSPHONIC ACID DERIVATIVES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-10-14 US disclosed
US-20100261677-A1 ARYLSULFONYLAMINOMETHYLPHOSPHONIC ACID DERIVATIVES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-10-14 US disclosed
WO-2009030715-A1 ARYLSULFONYLAMINOMETHYLPHOSPHONIC ACID DERIVATIVES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-03-12 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100261677-A1 ARYLSULFONYLAMINOMETHYLPHOSPHONIC ACID DERIVATIVES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS ARSA, SULT2A1, PMM2 MAPT 4830/4885TP53 4051/4885THRB 2319/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.