SCHEMBL1567096

SCHEMBL1567096

Fc1ccccc1[I+]c1ccccc1F.O=S(=O)([O-])C1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.37
GAA P10253 2/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KMT2A Q03164 4/20 0.35
MEN1 O00255 3/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
EPHX2 P34913 1/20 0.33
SCN9A Q15858 1/20 0.33
CXCR2 P25025 1/20 0.33
PAX8 Q06710 1/20 0.33
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33

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
SCHEMBL1568758 0.91 RIPK1 (0.35) PTGS2KMT2AALDH1A1PSEN1PSEN2
SCHEMBL1568484 0.78 PTGS2 (0.39) PTGS2KMT2AMEN1ALDH1A1ACHE
SCHEMBL1568370 0.77 HTR6 (0.37) GAAALDH1A1
SCHEMBL7902406 0.76 LMNA (0.36) PTGS2KMT2AMEN1KDM4EALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL1568498 0.75 GPR3 (0.46) PTGS2ACHE
SCHEMBL7905668 0.75 ALDH1A1 (0.42) GAAKMT2AMEN1KDM4EALDH1A1
SCHEMBL1568691 0.73 ACHE (0.41) ALDH1A1NPC1RAB9AACHE
SCHEMBL126719 0.71 CA7 (0.48) HTTKMT2AMEN1KDM4EALDH1A1
Potassium Ion SCHEMBL11696318 0.71 CA7 (0.42) HTTKMT2AMEN1KDM4EALDH1A1
Zinc Ion SCHEMBL7097317 0.71 CA7 (0.42) HTTKMT2AMEN1KDM4EALDH1A1

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
EP-2307393-B1 A PROCESS FOR THE PREPARATION OF THE APOPTOSIS PROMOTER ABT-263 ABBOTT LAB (US) 2013-04-10 EP disclosed
US-8168784-B2 Processes to make apoptosis promoters ABBOTT LABORATORIES (US) 2012-05-01 US disclosed
EP-2307393-A1 A PROCESS FOR THE PREPARATION OF THE APOPTOSIS PROMOTER ABT-263 Abbott Laboratories (US) 2011-04-13 EP disclosed
US-20090318689-A1 Processes To Make Apoptosis Promoters ABBOTT LABORATORIES (US) 2009-12-24 US disclosed
WO-2009155386-A1 A PROCESS FOR THE PREPARATION OF THE APOPTOSIS PROMOTER ABT-263 ABBOTT LABORATORIES (US) 2009-12-23 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-20090318689-A1 Processes To Make Apoptosis Promoters BAX, BCL2, CCAR2 PTGS2 2110/4885GAA 3539/4885HTT 3001/4885

“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.