SCHEMBL5373579

SCHEMBL5373579

Cc1ccsc1CSc1nc(Nc2ccccc2)n[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
TP53 P04637 1/20 0.44
POLB P06746 1/20 0.44
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
TSHR P16473 2/20 0.42
NFKB1 P19838 1/20 0.42
CASP3 P42574 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
GAA P10253 1/20 0.42
GFER P55789 1/20 0.42
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 1/20 0.41
MMP2 P08253 1/20 0.41
MMP10 P09238 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
SCHEMBL5371816 0.91 METAP2 (0.42) MAPTTP53POLBNPC1RAB9A
SCHEMBL5385452 0.89 CDK2 (0.44) MAPTTP53POLBNPC1RAB9A
SCHEMBL5382969 0.88 SYK (0.39) MAPTTP53POLBNPC1RAB9A
SCHEMBL5381220 0.87 METAP2 (0.43) MAPTTP53NPC1RAB9ASMN1; SMN2
SCHEMBL5373679 0.86 GAA (0.42) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL5378877 0.82 ALDH1A1 (0.43) MAPTPOLBNPC1RAB9ASMN1; SMN2
SCHEMBL5376577 0.82 METAP2 (0.47) MAPTTP53POLBNPC1ALDH1A1
SCHEMBL5387273 0.80 METAP2 (0.53) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL5374255 0.79 METAP2 (0.41) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL5373504 0.79 METAP2 (0.62) MAPTNPC1RAB9ASMN1; SMN2MEN1

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 MAPT 2319/4885TP53 1750/4885POLB 1040/4885

“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.