SCHEMBL5377316

SCHEMBL5377316

COc1ccc(Nc2n[nH]c(SCc3cccs3)n2)cc1OC

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 12/20 0.46
PKM P14618 1/20 0.44
ABCB1 P08183 1/20 0.41
ABCC1 P33527 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.41
LMNA P02545 2/20 0.40
PIM1 P11309 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CHEK1 O14757 1/20 0.39

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
SCHEMBL5376986 0.86 METAP2 (0.50) METAP2LMNAMEN1KMT2A
SCHEMBL6249119 0.85 MEN1 (0.52) METAP2PKMLMNAMEN1KMT2A
SCHEMBL5376455 0.83 METAP2 (0.46) METAP2PKMMEN1KMT2A
SCHEMBL7083896 0.83 METAP2 (0.43) METAP2ABCB1ABCC1ABCG2MEN1
SCHEMBL5373556 0.83 METAP2 (0.66) METAP2LMNA
SCHEMBL5377242 0.82 METAP2 (0.65) METAP2MEN1KMT2A
SCHEMBL5376830 0.82 METAP2 (0.67) METAP2MEN1KMT2ACHEK1
SCHEMBL5379154 0.82 METAP2 (0.50) METAP2LMNAMEN1KMT2A
SCHEMBL5372069 0.82 METAP2 (0.56) METAP2
SCHEMBL5385753 0.82 USP2 (0.47) LMNAMEN1KMT2A

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 1/4885PKM 2021/4885ABCB1 3195/4885

“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.