SCHEMBL1768435

SCHEMBL1768435

NC(CCNC(=O)NC1CCCCC1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 13/20 0.57
KDM4E B2RXH2 1/20 0.57
ALDH1A1 P00352 1/20 0.57
EPHX2 P34913 4/20 0.56

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
SCHEMBL1768433 1.00 EPHX1 (0.57) EPHX1KDM4EALDH1A1EPHX2
SCHEMBL1768694 0.98 EPHX1 (0.54) EPHX1KDM4EALDH1A1EPHX2
SCHEMBL1768691 0.98 EPHX1 (0.54) EPHX1KDM4EALDH1A1EPHX2
SCHEMBL13585343 0.92 EPHX2 (0.45) EPHX1KDM4EALDH1A1EPHX2
SCHEMBL13585340 0.92 EPHX2 (0.45) EPHX1KDM4EALDH1A1EPHX2
SCHEMBL13585537 0.85 EPHX1 (0.49) EPHX1KDM4EALDH1A1EPHX2
SCHEMBL13585539 0.85 EPHX1 (0.49) EPHX1KDM4EALDH1A1EPHX2
SCHEMBL1345188 0.85 SMN1; SMN2 (0.43) EPHX1KDM4EALDH1A1EPHX2
SCHEMBL1768775 0.84 EPHX1 (0.63) EPHX1KDM4EALDH1A1EPHX2
SCHEMBL1768784 0.84 EPHX1 (0.63) EPHX1KDM4EALDH1A1EPHX2

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
CN-102712676-B There is the peptidomimetic that the template of CCR10 antagonistic activity is fixing 波利弗尔股份公司 2016-10-26 CN disclosed
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
EP-2501715-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVTY Polyphor Ag (CH) 2012-09-26 EP disclosed
WO-2011060937-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVTY 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 EPHX1 2469/4885KDM4E 4722/4885ALDH1A1 3484/4885

“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.