SCHEMBL5263263

SCHEMBL5263263

NC(=O)O[C@H]1CC[C@H](NC(=O)O)CC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 4/20 0.41
ATM Q13315 1/20 0.36
POLB P06746 1/20 0.35
EPHX2 P34913 9/20 0.34
SMYD3 Q9H7B4 2/20 0.34
MMP2 P08253 1/20 0.33
MMP8 P22894 1/20 0.33
TSHR P16473 1/20 0.33
FAAH O00519 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL5263260 1.00 EPHX1 (0.41) EPHX1ATMPOLBEPHX2SMYD3
SCHEMBL31366709 0.89 EPHX1 (0.56) EPHX1EPHX2MMP2MMP8NPC1
SCHEMBL30034737 0.89 EPHX1 (0.52) EPHX1ATMEPHX2MMP2MMP8
SCHEMBL30035740 0.87 EPHX1 (0.59) EPHX1EPHX2MMP2MMP8NPC1
SCHEMBL23573302 0.81 EPHX1 (0.57) EPHX1EPHX2NPC1MAPTRAB9A
SCHEMBL21378960 0.81 POLB (0.48) EPHX1ATMPOLBEPHX2SMYD3
SCHEMBL425737 0.80
SCHEMBL6816984 0.79 MMP2 (0.40) EPHX1POLBEPHX2SMYD3MMP2
SCHEMBL6823717 0.79 MMP2 (0.40) EPHX1POLBEPHX2SMYD3MMP2
SCHEMBL19692400 0.78 MTNR1A (0.39) EPHX1SMYD3SMN1; SMN2

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
EP-1399443-B1 NITROGEN-CONTAINING BICYCLIC HETEROCYCLES FOR USE AS ANTIBACTERIALS SMITHKLINE BEECHAM PLC (GB) 2007-12-12 EP disclosed
US-20070135422-A1 Nitrogen-containing bicycle heterocycles for use as antibacterials SMITHKLINE BEECHAM P.L.C. 2007-06-14 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-20070135422-A1 Nitrogen-containing bicycle heterocycles for use as antibacterials NRDC, NUCB2, NISCH EPHX1 4021/4885ATM 3601/4885POLB 822/4885

“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.