SCHEMBL5631983

SCHEMBL5631983

COc1ccc(S(=O)(=O)c2ccc3cc(Br)ccc3c2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.63
GAA P10253 1/20 0.54
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
LMNA P02545 1/20 0.50
HTT P42858 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
PLAU P00749 1/20 0.49
RAPGEF4 Q8WZA2 1/20 0.49
IDO1 P14902 1/20 0.48
RXFP1 Q9HBX9 2/20 0.47
CA2 P00918 3/20 0.47
TSHR P16473 2/20 0.46
KDM4E B2RXH2 1/20 0.46
POLB P06746 2/20 0.45
GPR55 Q9Y2T6 1/20 0.45
CA1 P00915 1/20 0.45
MAPK1 P28482 1/20 0.44

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
SCHEMBL1991895 0.86 PKM (0.79) PKMGAAMEN1KMT2ALMNA
SCHEMBL5526773 0.86 CYP2A6 (0.50) PKMMEN1KMT2ALMNACA2
SCHEMBL8978602 0.82 CA2 (0.48) PKMGAAMEN1KMT2ALMNA
SCHEMBL13241565 0.80 PKM (0.63) PKMGAAMEN1KMT2AL3MBTL1
SCHEMBL29967341 0.80 CYP2A6 (0.60) MEN1KMT2AL3MBTL1LMNARXFP1
SCHEMBL227023 0.80 CYP2A6 (0.60) MEN1KMT2AL3MBTL1LMNARXFP1
SCHEMBL14486413 0.80 PKM (1.00) PKMGAAHTTRAPGEF4CA2
SCHEMBL835692 0.80 PKM (1.00) PKMGAAHTTRAPGEF4CA2
SCHEMBL13074716 0.80 PKM (1.00) PKMGAAHTTRAPGEF4CA2
SCHEMBL5632873 0.79 GAA (0.49) PKMGAALMNARAPGEF4CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7173025-B1 Aminoheterocyclic derivatives as antithrombotic or anticoagulant agents ZENECA LIMITED (GB) 2007-02-06 US disclosed
EP-0880502-B1 AMINOHETEROCYCLIC DERIVATIVES AS ANTITHROMBOTIC OR ANTICOAGULANT AGENTS ASTRAZENECA AB (SE) 2004-09-01 EP disclosed
US-20030207882-A1 Aminoheterocyclic derivatives as antithrombotic or anticoagulant agents ZENECA LIMITED 2003-11-06 US disclosed
EP-0880502-A1 AMINOHETEROCYCLIC DERIVATIVES AS ANTITHROMBOTIC OR ANTICOAGULANT AGENTS ZENECA LIMITED (GB) 1998-12-02 EP disclosed
WO-1997028129-A1 AMINOHETEROCYCLIC DERIVATIVES AS ANTITHROMBOTIC OR ANTICOAGULANT AGENTS ZENECA LIMITED (GB) 1997-08-07 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-20030207882-A1 Aminoheterocyclic derivatives as antithrombotic or anticoagulant agents F2, SERPINC1, F11 PKM 4016/4885GAA 2625/4885MEN1 594/4885

“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.