SCHEMBL6407161

SCHEMBL6407161

N#CCSc1nnc(-c2cccnc2)n1Cc1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.71
HTT P42858 1/20 0.70
L3MBTL1 Q9Y468 1/20 0.61
KDM4E B2RXH2 3/20 0.60
LMNA P02545 1/20 0.60
TSHR P16473 4/20 0.56
ATM Q13315 1/20 0.56
MAPK1 P28482 2/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
USP2 O75604 2/20 0.54
MAPT P10636 1/20 0.54
GLA P06280 1/20 0.54
HSD17B10 Q99714 1/20 0.53

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
SCHEMBL15983422 0.85 ALDH1A1 (0.80) ALDH1A1L3MBTL1KDM4ELMNATSHR
SCHEMBL15983644 0.81 ALDH1A1 (0.77) ALDH1A1L3MBTL1KDM4ELMNATSHR
SCHEMBL6410613 0.81 KMT2A (0.76) ALDH1A1HTTLMNATSHRMAPK1
SCHEMBL6407431 0.81 ALDH1A1 (0.69) ALDH1A1HTTL3MBTL1KDM4ELMNA
SCHEMBL6402415 0.80 ALDH1A1 (0.74) ALDH1A1L3MBTL1KDM4ELMNATSHR
SCHEMBL15983638 0.80 ALDH1A1 (0.74) ALDH1A1L3MBTL1KDM4ELMNATSHR
SCHEMBL6061302 0.80 ALDH1A1 (0.74) ALDH1A1HTTL3MBTL1KDM4ELMNA
SCHEMBL18556536 0.79 LMNA (0.68) ALDH1A1L3MBTL1LMNATSHRMAPK1
SCHEMBL4206347 0.76 ALDH1A1 (0.78) ALDH1A1HTTL3MBTL1LMNATSHR
SCHEMBL15986576 0.76 ALDH1A1 (1.00) ALDH1A1L3MBTL1KDM4ETSHRATM

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 ALDH1A1 720/4885HTT 2113/4885L3MBTL1 2749/4885

“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.