SCHEMBL4236035

SCHEMBL4236035

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nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.42
TSHR P16473 2/20 0.42
MAPT P10636 1/20 0.38
ALDH1A1 P00352 3/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KMT2A Q03164 1/20 0.36
FAAH O00519 1/20 0.36
HPGD P15428 2/20 0.35
HSD17B10 Q99714 1/20 0.35
LMNA P02545 2/20 0.33
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL30416403 0.81 ATM (0.43) MAPTALDH1A1KMT2AHPGDHSD17B10
SCHEMBL25384931 0.81 ATM (0.43) MAPTALDH1A1KMT2AHPGDHSD17B10
SCHEMBL19137249 0.76 HPGD (0.42) SMN1; SMN2TSHRMAPTALDH1A1NPSR1
SCHEMBL2901203 0.75 SMN1; SMN2 (0.41) SMN1; SMN2TSHRMAPTALDH1A1NPSR1
SCHEMBL19548912 0.75 GRIK1 (0.33) TSHRLMNA
SCHEMBL28887297 0.74 SMN1; SMN2 (0.50) SMN1; SMN2TSHRMAPTALDH1A1NPSR1
SCHEMBL14691340 0.72 GRIK1 (0.32)
SCHEMBL9213342 0.71 TSHR (0.47) SMN1; SMN2TSHRMAPTALDH1A1NPSR1
SCHEMBL8638571 0.70 SMN1; SMN2 (0.38) SMN1; SMN2TSHRMAPTALDH1A1NPSR1
SCHEMBL29988 0.70

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-20090306066-A1 PEPTIDE DEFORMYLASE INHIBITORS GLAXOSMITHKLINE LLC 2009-12-10 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 (2 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 SMN1; SMN2 3860/4885TSHR 2947/4885MAPT 4508/4885
US-20090306066-A1 PEPTIDE DEFORMYLASE INHIBITORS PDF, DHPS, PADI3 SMN1; SMN2 3262/4885TSHR 3052/4885MAPT 4456/4885

“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.