SCHEMBL2146100

SCHEMBL2146100

O=S(=O)(Nc1ccc(I)cc1F)c1c(Cl)cccc1Cl

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.51
CA1 P00915 6/20 0.47
CA2 P00918 6/20 0.47
AXL P30530 1/20 0.47
SLC40A1 Q9NP59 2/20 0.45
PTGES2 Q9H7Z7 2/20 0.43
CCR2 P41597 1/20 0.43
ACLY P53396 3/20 0.42
BRD4 O60885 1/20 0.42
MAP2K1 Q02750 1/20 0.41
ATM Q13315 1/20 0.40
MEN1 O00255 1/20 0.40
TSHR P16473 1/20 0.40
KMT2A Q03164 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
SCHEMBL2146366 0.85 PTGES2 (0.61) SLC40A1PTGES2ACLYBRD4
SCHEMBL2145893 0.77 MCL1 (0.64) MCL1AXLSLC40A1CCR2ACLY
SCHEMBL9464328 0.77 MAP2K1 (0.61) CA1CA2SLC40A1ACLYMAP2K1
SCHEMBL20783152 0.75 ALDH1A1 (0.49) PTGES2BRD4TSHRKMT2A
SCHEMBL5090048 0.73 PTGES2 (0.51) PTGES2CCR2ACLYMAP2K1
SCHEMBL9464640 0.73 ACLY (0.62) MCL1ACLYTSHR
SCHEMBL1542413 0.73 MAP2K1 (0.43) MAP2K1
SCHEMBL27183049 0.71 CA2 (0.43) CA1CA2MAP2K1
SCHEMBL9464838 0.70 PSIP1 (0.59) MAP2K1
SCHEMBL25803034 0.70 CA2 (0.62) CA1CA2MAP2K1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2521725-B1 ARYLSULFONAMIDE PYRIDINE-PYRIDINONE DERIVATIVES, PREPARATION OF SAME, AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2013-11-27 EP disclosed
US-20130178472-A1 ARYLSULFONAMIDE PYRIDINE-PYRIDINONE DERIVATIVES, PREPARATION OF SAME, AND THERAPEUTIC USE THEREOF SANOFI (FR) 2013-07-11 US disclosed
EP-2521725-A1 ARYLSULFONAMIDE PYRIDINE-PYRIDINONE DERIVATIVES, PREPARATION OF SAME, AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-11-14 EP disclosed
WO-2011083275-A1 ARYLSULFONAMIDE PYRIDINE-PYRIDINONE DERIVATIVES, PREPARATION OF SAME, AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-07-14 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-20130178472-A1 ARYLSULFONAMIDE PYRIDINE-PYRIDINONE DERIVATIVES, PREPARATION OF SAME, AND THERAPEUTIC USE THEREOF NDUFS2, NDUFS6, NDUFS3 MCL1 3209/4885CA1 4666/4885CA2 4025/4885

“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.