SCHEMBL5371983

SCHEMBL5371983

COc1ccccc1CSc1nc(Nc2ccccc2C)n[nH]1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 7/20 0.66
SLC2A1 P11166 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
KDM1A O60341 1/20 0.44
GAA P10253 1/20 0.44
HSD17B10 Q99714 1/20 0.44
RCOR1 Q9UKL0 1/20 0.44
CTSB P07858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL5396948 0.92 METAP2 (0.55) METAP2SMN1; SMN2KDM1AGAAHSD17B10
SCHEMBL5373695 0.91 METAP2 (0.54) METAP2SLC2A1SMN1; SMN2KDM1AGAA
SCHEMBL5381685 0.89 METAP2 (0.52) METAP2SMN1; SMN2KDM1AGAAHSD17B10
SCHEMBL5372346 0.88 METAP2 (0.53) METAP2SLC2A1SMN1; SMN2KDM1AGAA
SCHEMBL5387236 0.88 METAP2 (0.62) METAP2SMN1; SMN2GAANPSR1ALDH1A1
SCHEMBL5381797 0.86 METAP2 (0.49) METAP2SLC2A1SMN1; SMN2KDM1AGAA
SCHEMBL5392093 0.86 METAP2 (0.49) METAP2SMN1; SMN2KDM1AGAAHSD17B10
SCHEMBL5382602 0.84 METAP2 (0.54) METAP2SMN1; SMN2KDM1AGAAHSD17B10
SCHEMBL5372033 0.84 METAP2 (0.65) METAP2SMN1; SMN2HSD17B10NPSR1ALDH1A1
SCHEMBL5382003 0.84 METAP2 (0.52) METAP2SMN1; SMN2KDM1AGAAHSD17B10

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-7304082-B2 1,2,4-triazole derivatives, compositions, process of making and methods of use SMITHKLINE BEECHAM CORPORATION (US) 2007-12-04 US disclosed
US-20050267185-A1 1,2,4-triazole derivatives, compositions, process of making and methods of use SMITHKLINE BEECHAM CORPORATION 2005-12-01 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-20050267185-A1 1,2,4-triazole derivatives, compositions, process of making and methods of use METAP2, METAP1, DNPEP METAP2 1/4885SLC2A1 1376/4885SMN1; SMN2 4773/4885

“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.