SCHEMBL5597963

SCHEMBL5597963

O=C(O)c1cc(Br)ccc1NS(=O)(=O)c1csc2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 1/20 0.62
MCL1 Q07820 6/20 0.55
BCL2L1 Q07817 3/20 0.55
METAP2 P50579 4/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
CYP3A4 P08684 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
KDM1A O60341 1/20 0.47
ACLY P53396 1/20 0.45
ALDH1A1 P00352 2/20 0.44
BCL2A1 Q16548 1/20 0.43
PDPK1 O15530 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
WDR5 P61964 1/20 0.42

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
SCHEMBL3985574 0.80 METAP2 (0.60) MCL1BCL2L1METAP2MEN1KMT2A
SCHEMBL14042232 0.77 CCKBR (1.00) CCKBR
SCHEMBL13077397 0.76 LMNA (0.53) CCKBRMETAP2MEN1KMT2AALDH1A1
SCHEMBL28981 0.76 LMNA (0.58) CCKBRKMT2AALDH1A1PDPK1
SCHEMBL9997083 0.75 PFKFB3 (0.65) CCKBRMCL1BCL2L1MEN1KMT2A
SCHEMBL25072652 0.74 RAD52 (0.56) MEN1KMT2AACLYALDH1A1HPGD
SCHEMBL14459502 0.72 METAP2 (0.62) MCL1BCL2L1METAP2MEN1KMT2A
SCHEMBL5606531 0.72 CCKBR (0.40) CCKBRMCL1BCL2L1MEN1KMT2A
SCHEMBL18392246 0.71 MCL1 (1.00) MCL1BCL2L1CYP2C9HSD17B10
SCHEMBL29539772 0.71 MCL1 (1.00) MCL1BCL2L1CYP2C9HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1815860-A2 Phosphate transport inhibitors GENZYME CORPORATION (US) 2007-08-08 EP disclosed
EP-1815860-A2 Phosphate transport inhibitors GENZYME CORPORATION (US) 2007-08-08 EP disclosed
US-20070021509-A1 Phosphate transport inhibitors JOZEFIAK THOMAS H 2007-01-25 US disclosed
US-20070021509-A1 Phosphate transport inhibitors JOZEFIAK THOMAS H 2007-01-25 US disclosed
US-20070021509-A1 Phosphate transport inhibitors JOZEFIAK THOMAS H 2007-01-25 US disclosed
US-7119120-B2 Phosphate transport inhibitors GENZYME CORPORATION (US) 2006-10-10 US disclosed
EP-1465638-A2 PHOSPHATE TRANSPORT INHIBITORS GENZYME CORPORATION (US) 2004-10-13 EP disclosed
US-20040019113-A1 Phosphate transport inhibitors GELTEX PHARMACEUTICALS, INC. 2004-01-29 US disclosed
WO-2003057225-A2 PHOSPHATE TRANSPORT INHIBITORS GENZYME CORPORATION (US) 2003-07-17 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 (2 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-20040019113-A1 Phosphate transport inhibitors SLC34A1, SLC34A2, SLC20A1 CCKBR 2241/4885MCL1 4869/4885BCL2L1 4820/4885
US-20070021509-A1 Phosphate transport inhibitors SLC34A2, SLC34A1, SLC20A1 CCKBR 3668/4885MCL1 4827/4885BCL2L1 4691/4885

“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.