SCHEMBL13584361

SCHEMBL13584361

COCCNC(=O)NCC(N)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GFPT1 Q06210 1/20 0.49
▸ CASR P41180 8/20 0.44
▸ GAA P10253 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ SLC7A5 Q01650 1/20 0.38
▸ DDAH1 O94760 1/20 0.38

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
SCHEMBL13584359 1.00 GFPT1 (0.49) GFPT1CASRGAAMEN1KMT2A
SCHEMBL1768690 0.86 DDAH1 (0.44) GFPT1GAAMEN1KMT2AHPGD
SCHEMBL1768693 0.86 DDAH1 (0.44) GFPT1GAAMEN1KMT2AHPGD
SCHEMBL2237950 0.80 GFPT1 (0.45) GFPT1HPGDSLC7A5DDAH1
SCHEMBL2237956 0.80 GFPT1 (0.45) GFPT1HPGDSLC7A5DDAH1
SCHEMBL6468831 0.79 GAA (0.55) GAAMEN1KMT2AHPGD
SCHEMBL1768739 0.79 CASR (0.45) GFPT1CASRSLC7A5
SCHEMBL1768743 0.79 CASR (0.45) GFPT1CASRSLC7A5
SCHEMBL13585557 0.78 CASR (0.43) GFPT1CASRSLC7A5
SCHEMBL13585036 0.78 GFPT1 (0.42) GFPT1CASRMEN1KMT2ASLC7A5

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 2 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

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 GFPT1 3069/4885CASR 469/4885GAA 1779/4885

“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.

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