SCHEMBL5382952

SCHEMBL5382952

Cc1ccccc1CSc1nc(Nc2ccccc2-c2ccccc2)n[nH]1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 10/20 0.49
ALDH1A1 P00352 3/20 0.46
KMT2A Q03164 1/20 0.46
LMNA P02545 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPK1 P28482 1/20 0.44
HPGD P15428 2/20 0.42
GAA P10253 1/20 0.42
NPSR1 Q6W5P4 2/20 0.40
MAPT P10636 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
SCHEMBL5387236 0.88 METAP2 (0.62) METAP2ALDH1A1KMT2ALMNASMN1; SMN2
SCHEMBL5376396 0.86 METAP2 (0.66) METAP2ALDH1A1KMT2ALMNAL3MBTL1
SCHEMBL5381797 0.86 METAP2 (0.49) METAP2ALDH1A1KMT2ASMN1; SMN2MAPK1
SCHEMBL5393592 0.85 METAP2 (0.52) METAP2ALDH1A1KMT2ALMNASMN1; SMN2
SCHEMBL5373542 0.84 METAP2 (0.62) METAP2ALDH1A1SMN1; SMN2NPSR1
SCHEMBL5387273 0.83 METAP2 (0.53) METAP2ALDH1A1KMT2ALMNASMN1; SMN2
SCHEMBL5377220 0.82 METAP2 (0.49) METAP2ALDH1A1KMT2ALMNASMN1; SMN2
SCHEMBL5373695 0.82 METAP2 (0.54) METAP2ALDH1A1KMT2ASMN1; SMN2KDM4E
SCHEMBL5380588 0.81 SMN1; SMN2 (0.50) METAP2ALDH1A1KMT2ALMNASMN1; SMN2
SCHEMBL5381733 0.81 METAP2 (0.51) METAP2ALDH1A1KMT2ALMNASMN1; 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
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 1/4885ALDH1A1 1754/4885KMT2A 1092/4885

“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.