SCHEMBL5376475

SCHEMBL5376475

CCc1ccccc1Nc1n[nH]c(SCc2cc(C)on2)n1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 9/20 0.53
GAA P10253 2/20 0.42
LMNA P02545 2/20 0.42
MAPT P10636 1/20 0.38
KMT2A Q03164 2/20 0.36
TSHR P16473 2/20 0.36
HSD17B10 Q99714 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36
OPRM1 P35372 1/20 0.36
CASP1 P29466 1/20 0.35
GLA P06280 1/20 0.35

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
SCHEMBL5376901 0.89 METAP2 (0.66) METAP2LMNAMAPTTP53
SCHEMBL5372134 0.84 METAP2 (0.53) METAP2MAPTKMT2AALDH1A1
SCHEMBL5391990 0.84 METAP2 (0.53) METAP2LMNAMAPTHSD17B10ALDH1A1
SCHEMBL5387535 0.84 METAP2 (0.69) METAP2MAPTALDH1A1
SCHEMBL5371852 0.84 METAP2 (0.55) METAP2GAALMNAMAPTKMT2A
SCHEMBL5382902 0.81 LMNA (0.48) METAP2GAALMNAMAPTALDH1A1
SCHEMBL5393592 0.81 METAP2 (0.52) METAP2GAALMNAMAPTKMT2A
SCHEMBL5371807 0.80 RAB9A (0.45) METAP2GAAKMT2ATSHRHSD17B10
SCHEMBL5385578 0.79 METAP2 (0.65) METAP2GAALMNAMAPTKMT2A
SCHEMBL5376459 0.79 METAP2 (0.53) METAP2LMNAMAPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1223932-A4 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORP (US) 2003-01-15 EP claimed
EP-1223932-A1 COMPOUNDS AND METHODS SmithKline Beecham Corporation (US) 2002-07-24 EP claimed
WO-2001024796-A1 1,2,4-TRIAZOLE DERIVATIVES, COMPOSITION, PROCESS OF MAKING AND METHODS OF USE SMITHKLINE BEECHAM CORPORATION (US) 2001-04-12 WO claimed
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 1/4885GAA 2089/4885LMNA 4783/4885

“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.