SCHEMBL3146412

SCHEMBL3146412

C=CCOC(=O)CSC[C@H](N)C(=O)OCC=C

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.46
TDP1 Q9NUW8 1/20 0.37
TSHR P16473 2/20 0.37
MAPT P10636 1/20 0.33
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
CYP3A4 P08684 1/20 0.32
PKM P14618 1/20 0.31
ALDH1A1 P00352 2/20 0.31
HSD17B10 Q99714 1/20 0.31
GAA P10253 1/20 0.30

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
SCHEMBL557341 0.83 MAPT (0.35) SMN1; SMN2TDP1TSHRMAPTCACNA1B
SCHEMBL3634048 0.82 MAPT (0.39) SMN1; SMN2TDP1TSHRMAPTCACNA1B
SCHEMBL3637092 0.82 MAPT (0.39) SMN1; SMN2TDP1TSHRMAPTCACNA1B
SCHEMBL15703475 0.80 MAPT (0.33) SMN1; SMN2TDP1TSHRMAPTCACNA1B
SCHEMBL24247663 0.79 MAPT (0.33) SMN1; SMN2TDP1TSHRMAPTCACNA1B
SCHEMBL176160 0.77 TDP1 (0.46) SMN1; SMN2TDP1TSHRMAPTCACNA1B
SCHEMBL1023364 0.77 TDP1 (0.46) SMN1; SMN2TDP1TSHRMAPTCACNA1B
SCHEMBL2286672 0.76 MAPT (0.40) SMN1; SMN2TDP1TSHRMAPTCACNA1B
SCHEMBL2516533 0.76 MAPT (0.40) SMN1; SMN2TDP1TSHRMAPTCACNA1B
SCHEMBL3634453 0.76 GRIK1 (0.41) TDP1TSHRMAPTCACNA1BAPBA1

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-7705050-B2 Amides, useful in the inhibition of IL-8-induced chemotaxis of neutrophils DOMPÉ FARMACEUTICI S.P.A. (IT) 2010-04-27 US disclosed
EP-1255726-B1 (R)-2-ARYL-PROPIONAMIDES, USEFUL IN THE INHIBITION OF IL-8 INDUCED CHEMIOTAXIS OF NEUTROPHILS DOMPE PHA R MA SPA RES & MFG (IT) 2009-11-11 EP disclosed
US-20040181073-A1 Amides, useful in the inhibition of il-8-induced chemotaxis of neutrophils DOMPÉ FARMACEUTICI S.P.A. (IT) 2004-09-16 US disclosed
EP-1255726-A2 (R)-2-ARYL-PROPIONAMIDES, USEFUL IN THE INHIBITION OF IL-8 INDUCED CHEMIOTAXIS OF NEUTROPHILS Dompé S.P.A. (IT) 2002-11-13 EP disclosed
WO-2001058852-A2 (R)-2-ARYL-PROPIONAMIDES, USEFUL IN THE INHIBITION OF IL-8-INDUCED CHEMIOTAXIS OF NEUTROPHILS Dompé S.p.A. (IT) 2001-08-16 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-20040181073-A1 Amides, useful in the inhibition of il-8-induced chemotaxis of neutrophils CXCL8, MMP8, CCR8 SMN1; SMN2 3442/4885TDP1 4838/4885TSHR 3081/4885

“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.