SCHEMBL1189227

SCHEMBL1189227

O=C(O)N1CC(O)C(O)C1Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FUCA1 P04066 2/20 0.47
GAA P10253 4/20 0.47
GBA1 P04062 6/20 0.43
ABCB1 P08183 1/20 0.41
TACR3 P29371 1/20 0.39
S1PR1 P21453 1/20 0.39
S1PR5 Q9H228 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 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
SCHEMBL1189833 1.00 FUCA1 (0.47) FUCA1GAAGBA1ABCB1TACR3
SCHEMBL17542008 0.90 ABCB1 (0.43) FUCA1GAAGBA1ABCB1TACR3
SCHEMBL28879326 0.90 ABCB1 (0.43) FUCA1GAAGBA1ABCB1TACR3
SCHEMBL17610289 0.84 ABCB1 (0.43) FUCA1ABCB1TACR3S1PR1S1PR5
SCHEMBL1189349 0.84 ABCB1 (0.43) FUCA1ABCB1TACR3S1PR1S1PR5
SCHEMBL14692745 0.84 ABCB1 (0.40) FUCA1GAAGBA1ABCB1TACR3
SCHEMBL17801553 0.81 PSEN1 (0.40) ABCB1
SCHEMBL17542526 0.79 ALDH1A1 (0.37) MEN1KMT2A
SCHEMBL18577142 0.79 TSHR (0.42) GAAS1PR5
SCHEMBL17542235 0.79 TACR3 (0.43) ABCB1TACR3

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-20130045962-A1 PEPTIDE DEFORMYLASE INHIBITORS GLAXOSMITHKLINE LLC 2013-02-21 US disclosed
US-7893056-B2 Peptide deformylase inhibitors GLAXOSMITHKLINE LLC (US) 2011-02-22 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-20130045962-A1 PEPTIDE DEFORMYLASE INHIBITORS PDF, DPEP1, DHPS FUCA1 991/4885GAA 1321/4885GBA1 1537/4885

“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.