SCHEMBL6405958

SCHEMBL6405958

Cc1nnc(SCC(=O)Nc2cccc(Cl)c2)n1C

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.71
MEN1 O00255 1/20 0.71
POLB P06746 3/20 0.60
L3MBTL1 Q9Y468 3/20 0.59
TSHR P16473 1/20 0.59
MAPK1 P28482 1/20 0.59
TACR1 P25103 1/20 0.58
TP53 P04637 1/20 0.58
ALDH1A1 P00352 3/20 0.58
CTDSP1 Q9GZU7 1/20 0.56
MAPT P10636 2/20 0.56
HCRTR1 O43613 1/20 0.55
HCRTR2 O43614 1/20 0.55
PAX8 Q06710 1/20 0.55
GAA P10253 1/20 0.54

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
SCHEMBL4210387 0.83 GAA (0.81) KMT2AMEN1L3MBTL1TSHRMAPK1
SCHEMBL14027531 0.81 POLB (0.77) KMT2AMEN1POLBL3MBTL1TP53
SCHEMBL4212345 0.78 TSHR (0.72) KMT2AMEN1POLBL3MBTL1TSHR
SCHEMBL4211049 0.77 TSHR (0.72) KMT2AMEN1POLBL3MBTL1TSHR
SCHEMBL6408638 0.77 TP53 (0.74) KMT2APOLBL3MBTL1TSHRMAPK1
SCHEMBL12858779 0.76 KMT2A (0.76) KMT2AMEN1POLBL3MBTL1TACR1
SCHEMBL4216766 0.75 TSHR (0.60) KMT2AMEN1POLBL3MBTL1TSHR
SCHEMBL4207384 0.74 TSHR (0.68) POLBL3MBTL1TSHRMAPK1TACR1
SCHEMBL14732084 0.73 L3MBTL1 (0.62) POLBL3MBTL1TSHRMAPK1TP53
SCHEMBL4206084 0.73 TSHR (0.73) KMT2AMEN1POLBL3MBTL1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050288347-A1 Certain triazole-based compounds, compositions, and uses thereof AGRIUS GROUP, LLC. 2005-12-29 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-20050288347-A1 Certain triazole-based compounds, compositions, and uses thereof ABCG2, ATP5ME, DNTT KMT2A 2263/4885MEN1 3562/4885POLB 854/4885

“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.