SCHEMBL178852

SCHEMBL178852

O=c1nc(NCCCNCc2cc(Br)cc(Br)c2)[nH]c2sccc12

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 1/20 0.40

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
SCHEMBL178856 0.84 SLC2A1 (0.43) SLC2A1
SCHEMBL178850 0.81 MARS1 (0.46) —
SCHEMBL178849 0.80 MARS1 (0.47) —
Hydrochloric Acid SCHEMBL8202914 0.79 MARS1 (0.46) —
SCHEMBL10069524 0.78 SLC2A1 (0.48) SLC2A1
SCHEMBL10069521 0.76 SLC2A1 (0.43) SLC2A1
SCHEMBL178860 0.75 MARS1 (0.47) SLC2A1
SCHEMBL178862 0.73 SLC2A1 (0.52) SLC2A1
SCHEMBL178880 0.72 XDH (0.38) —
SCHEMBL178883 0.71 BCHE (0.56) SLC2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120058133-A1 INHIBITION OF TRNA SYNTHETASES AND THERAPEUTIC APPLICATIONS THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-03-08 — — 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-20120058133-A1 INHIBITION OF TRNA SYNTHETASES AND THERAPEUTIC APPLICATIONS THEREOF AARS1, GARS1, TRMT1 SLC2A1 4328/4885

“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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