SCHEMBL14855804

SCHEMBL14855804

O=C1NCCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1F

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 9/20 0.53
FEN1 P39748 8/20 0.53
TBXA2R P21731 2/20 0.43
DPP4 P27487 2/20 0.43
DPP7 Q9UHL4 2/20 0.43
KCNH2 Q12809 1/20 0.43
POLB P06746 1/20 0.42
HTR6 P50406 2/20 0.41
HDAC8 Q9BY41 1/20 0.40
APOL1 O14791 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
SCHEMBL14855805 1.00 ALOX5AP (0.53) ALOX5APFEN1TBXA2RDPP4DPP7
SCHEMBL14856078 0.90 ALOX5AP (0.53) ALOX5APFEN1APOL1
SCHEMBL15153322 0.90 ALOX5AP (0.53) ALOX5APFEN1APOL1
SCHEMBL14856175 0.84 ALOX5AP (0.58) ALOX5APFEN1HTR6
SCHEMBL14856174 0.84 ALOX5AP (0.58) ALOX5APFEN1HTR6
SCHEMBL14855603 0.81 RB1 (0.49) ALOX5APFEN1TBXA2R
SCHEMBL14855604 0.81 RB1 (0.49) ALOX5APFEN1TBXA2R
SCHEMBL15153496 0.80 PSEN1 (0.49) ALOX5APFEN1HTR6HDAC8
SCHEMBL14855834 0.80 PSEN1 (0.49) ALOX5APFEN1HTR6HDAC8
SCHEMBL15924423 0.79 ALOX5AP (0.68) ALOX5APFEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130203734-A1 ANTI-INFLAMMATORY AGENTS GRAINGER DAVID JOHN (GB) 2013-08-08 US claimed
EP-2580197-A1 ANTI-INFLAMMATORY AGENTS Cambridge Enterprise Ltd. (GB) 2013-04-17 EP claimed
WO-2011154695-A1 ANTI-INFLAMMATORY AGENTS CAMBRIDGE ENTERPRISE LIMITED (GB) 2011-12-15 WO claimed
US-20130203734-A1 ANTI-INFLAMMATORY AGENTS GRAINGER DAVID JOHN (GB) 2013-08-08 US disclosed
US-20130203734-A1 ANTI-INFLAMMATORY AGENTS GRAINGER DAVID JOHN (GB) 2013-08-08 US disclosed
EP-2580197-A1 ANTI-INFLAMMATORY AGENTS Cambridge Enterprise Ltd. (GB) 2013-04-17 EP disclosed
WO-2011154695-A1 ANTI-INFLAMMATORY AGENTS CAMBRIDGE ENTERPRISE LIMITED (GB) 2011-12-15 WO disclosed
WO-2011154695-A1 ANTI-INFLAMMATORY AGENTS CAMBRIDGE ENTERPRISE LIMITED (GB) 2011-12-15 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-20130203734-A1 ANTI-INFLAMMATORY AGENTS IL6, TNF, IL1B ALOX5AP 332/4885FEN1 3636/4885TBXA2R 281/4885

“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.