SCHEMBL1769388

SCHEMBL1769388

CC(=O)NCCNS(=O)(=O)NC[C@H](N)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CASR P41180 4/20 0.39
CA12 O43570 2/20 0.37
CA14 Q9ULX7 2/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
GFPT1 Q06210 1/20 0.36
PMP22 Q01453 1/20 0.35
KDM4E B2RXH2 1/20 0.34
MAPK1 P28482 1/20 0.34
HIF1A Q16665 1/20 0.34
PAOX Q6QHF9 2/20 0.33
NOS2 P35228 1/20 0.33
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
GRIK1 P39086 1/20 0.33
ADRA1A P35348 1/20 0.33
SLC7A5 Q01650 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL1769392 1.00 CASR (0.39) CASRCA12CA14CA7CA9
SCHEMBL13585264 0.87 PMP22 (0.42) PMP22KDM4EMAPK1HIF1ANOS2
SCHEMBL13585269 0.87 PMP22 (0.42) PMP22KDM4EMAPK1HIF1ANOS2
SCHEMBL1769684 0.80 PTGS1 (0.39) CASRCA12CA14CA7CA9
SCHEMBL1769608 0.80 CA12 (0.38) CASRCA12CA14CA7CA9
SCHEMBL1769680 0.80 PTGS1 (0.39) CASRCA12CA14CA7CA9
SCHEMBL1769605 0.80 CA12 (0.38) CASRCA12CA14CA7CA9
SCHEMBL1769579 0.79 NOS2 (0.40) CASRPMP22KDM4EMAPK1HIF1A
SCHEMBL1769577 0.79 NOS2 (0.40) CASRPMP22KDM4EMAPK1HIF1A
SCHEMBL1769366 0.78 CA12 (0.50) CA12CA14CA7CA9GFPT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8754038-B2 Template-fixed peptidomimetics with CCR10 antagonistic activity POLYPHOR AG (CH) 2014-06-17 US disclosed
US-20120283168-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVITY POLYPHOR AG (CH) 2012-11-08 US disclosed
WO-2011060832-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVITY POLYPHOR AG (CH) 2011-05-26 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-20120283168-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVITY CCR10, CCR1, CCRL2 CASR 469/4885CA12 1013/4885CA14 1146/4885

“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.