SCHEMBL6405166

SCHEMBL6405166

Cc1cccc(-c2nnc(SCC(=O)NCc3ccccc3)n2C)c1

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.71
KMT2A Q03164 2/20 0.66
GAA P10253 2/20 0.66
RGS12 O14924 2/20 0.66
RXFP1 Q9HBX9 1/20 0.66
ALDH1A1 P00352 5/20 0.62
TP53 P04637 1/20 0.60
POLB P06746 2/20 0.60
PKM P14618 1/20 0.60
TSHR P16473 1/20 0.60
SENP1 Q9P0U3 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.57
APOBEC3A P31941 1/20 0.56
APOBEC3G Q9HC16 1/20 0.56

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
SCHEMBL6403470 0.87 HTT (0.70) MAPTKMT2AGAAALDH1A1POLB
SCHEMBL13856843 0.84 MAPT (0.65) MAPTKMT2AGAARGS12ALDH1A1
SCHEMBL14907898 0.82 ALDH1A1 (0.75) MAPTKMT2AGAARXFP1ALDH1A1
SCHEMBL1514509 0.82 KDM4E (0.66) MAPTKMT2AGAARGS12ALDH1A1
SCHEMBL6408638 0.81 TP53 (0.74) MAPTKMT2AGAARGS12RXFP1
SCHEMBL4203841 0.80 SENP1 (0.74) MAPTKMT2AGAARXFP1ALDH1A1
SCHEMBL18540561 0.80 ALDH1A1 (0.75) MAPTKMT2AGAARXFP1ALDH1A1
SCHEMBL4209228 0.79 THRB (0.65) MAPTKMT2ARXFP1ALDH1A1TP53
SCHEMBL4206188 0.77 MAPT (0.73) MAPTKMT2AGAARXFP1ALDH1A1
SCHEMBL17213042 0.77 ALDH1A1 (0.70) MAPTKMT2AGAARXFP1ALDH1A1

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 MAPT 2111/4885KMT2A 2263/4885GAA 85/4885

“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.