SCHEMBL13801280

SCHEMBL13801280

CNC(=O)NC1CCN(C=O)CC1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 11/20 0.44
EPHX1 P07099 8/20 0.42
ALDH1A1 P00352 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP3A4 P08684 1/20 0.38
KDM5A P29375 1/20 0.36

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
SCHEMBL7382591 0.81 EPHX2 (0.42) EPHX2EPHX1ALDH1A1KDM4E
SCHEMBL5567559 0.79 EPHX1 (0.39) EPHX2EPHX1ALDH1A1NPC1
SCHEMBL10271099 0.79 EPHX2 (0.46) EPHX2EPHX1ALDH1A1NPC1RAB9A
SCHEMBL10155582 0.77 EPHX2 (0.56) EPHX2EPHX1ALDH1A1NPC1RAB9A
SCHEMBL965099 0.77
SCHEMBL13801279 0.77 LTA4H (0.38) EPHX2EPHX1ALDH1A1
SCHEMBL2389051 0.76 CTSL (0.33)
SCHEMBL12522289 0.76 EPHX2 (0.71) EPHX2EPHX1
SCHEMBL10205154 0.74 EPHX2 (0.45) EPHX2EPHX1ALDH1A1NPC1RAB9A
SCHEMBL10218754 0.74 ALDH1A1 (0.59) EPHX2EPHX1ALDH1A1CYP3A4KDM5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090163480-A1 Modified amino acids, pharmaceuticals containing these compounds and method for their production DR. KARL THOMAE GMBH (DE) 2009-06-25 US disclosed
US-20090163480-A1 Modified amino acids, pharmaceuticals containing these compounds and method for their production DR. KARL THOMAE GMBH (DE) 2009-06-25 US disclosed
US-7498325-B2 Modified amino acids, pharmaceuticals containing these compounds and method for their production KARL THOMAS GMBH (DE) 2009-03-03 US disclosed
US-7498325-B2 Modified amino acids, pharmaceuticals containing these compounds and method for their production KARL THOMAS GMBH (DE) 2009-03-03 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-20090163480-A1 Modified amino acids, pharmaceuticals containing these compounds and method for their production PTMS, CHRM1, SRMS EPHX2 2553/4885EPHX1 2612/4885ALDH1A1 2929/4885

“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.