SCHEMBL5372409

SCHEMBL5372409

COc1ccccc1Nc1n[nH]c(SCc2ccc(F)c(F)c2)n1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 7/20 0.50
P2RX7 Q99572 3/20 0.48
MAPK1 P28482 1/20 0.45
EGFR P00533 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
GBA1 P04062 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
USP2 O75604 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
SCHEMBL5376915 0.89 SMN1; SMN2 (0.43) METAP2EGFRHTTSMN1; SMN2KDM4E
SCHEMBL5372437 0.88 METAP2 (0.52) METAP2P2RX7MAPK1HTTSMN1; SMN2
SCHEMBL5376834 0.86 METAP2 (0.67) METAP2P2RX7SMN1; SMN2
SCHEMBL5373564 0.86 GBA1 (0.50) METAP2EGFRHTTSMN1; SMN2KDM4E
SCHEMBL5387230 0.85 MAPT (0.48) METAP2EGFRSMN1; SMN2KDM4EALDH1A1
SCHEMBL5381456 0.84 METAP2 (0.51) METAP2P2RX7MAPK1SMN1; SMN2MAPT
SCHEMBL5393520 0.84 ALPL (0.53) METAP2EGFRSMN1; SMN2KDM4EALDH1A1
SCHEMBL5381440 0.83 METAP2 (0.50) METAP2MAPK1
SCHEMBL5391914 0.83 METAP2 (0.68) METAP2MAPK1
SCHEMBL5385018 0.82 METAP2 (0.48) METAP2HTTALDH1A1

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 8 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
EP-1223932-A4 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORP (US) 2003-01-15 EP disclosed
EP-1223932-A1 COMPOUNDS AND METHODS SmithKline Beecham Corporation (US) 2002-07-24 EP disclosed
WO-2001024796-A1 1,2,4-TRIAZOLE DERIVATIVES, COMPOSITION, PROCESS OF MAKING AND METHODS OF USE SMITHKLINE BEECHAM CORPORATION (US) 2001-04-12 WO 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 1/4885P2RX7 3236/4885MAPK1 3710/4885

“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.