SCHEMBL2098546

SCHEMBL2098546

O=P(O)(O)C(Cc1ccccc1)(Cc1ccccc1)NS(=O)(=O)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.42
ACLY P53396 9/20 0.40
PGR P06401 2/20 0.39
ITGB1 P05556 1/20 0.38
ITGA4 P13612 1/20 0.38
FABP4 P15090 2/20 0.38
CNR1 P21554 1/20 0.38
FLT1 P17948 1/20 0.37
FLT4 P35916 1/20 0.37
KDR P35968 1/20 0.37
BCL2L1 Q07817 1/20 0.37
MCL1 Q07820 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
SCHEMBL2098095 0.79 FLT1 (0.41) FDPSACLYFABP4FLT1FLT4
SCHEMBL2055340 0.66 BCL2L1 (0.44) ACLYPGRITGB1ITGA4FABP4
SCHEMBL2101138 0.65 FDPS (0.51) FDPS
SCHEMBL7360349 0.65 MMP2 (0.72) ITGB1ITGA4
SCHEMBL2098741 0.64 FABP4 (0.51) ACLYITGB1ITGA4FABP4FLT1
SCHEMBL9849577 0.64 FDPS (0.58) FDPS
SCHEMBL3762452 0.64 PGR (0.74) ACLYPGR
SCHEMBL14676834 0.63 ACLY (0.48) ACLYFABP4FLT1FLT4KDR
SCHEMBL7478862 0.63 MMP2 (0.51) PGRBCL2L1MCL1
SCHEMBL29182980 0.63 FDPS (0.62) FDPS

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
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

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 FDPS 91/4885ACLY 633/4885PGR 2258/4885

“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.