SCHEMBL6404088

SCHEMBL6404088

CCn1c(SCC(=O)OCc2ccccc2)nnc1-c1ccc(OC)cc1

nearest known ligand 0.78

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.78
ALOX15 P16050 2/20 0.66
TSHR P16473 2/20 0.66
HSD17B10 Q99714 1/20 0.66
GAA P10253 1/20 0.66
KMT2A Q03164 4/20 0.60
MEN1 O00255 3/20 0.60
ALPG P10696 1/20 0.58
TP53 P04637 1/20 0.56
USP2 O75604 1/20 0.56
MAPT P10636 1/20 0.56
LMNA P02545 2/20 0.55
MAPK1 P28482 1/20 0.54
RAB9A P51151 1/20 0.54
L3MBTL1 Q9Y468 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
SCHEMBL6411042 0.92 ALDH1A1 (0.66) ALDH1A1ALOX15TSHRHSD17B10GAA
SCHEMBL6409274 0.89 HTT (0.64) ALDH1A1ALOX15TSHRHSD17B10GAA
SCHEMBL4208335 0.87 ALDH1A1 (0.77) ALDH1A1ALOX15TSHRGAAKMT2A
SCHEMBL6404073 0.86 ALDH1A1 (0.63) ALDH1A1GAAKMT2AMEN1ALPG
SCHEMBL6402175 0.83 ALDH1A1 (0.60) ALDH1A1TSHRKMT2AMEN1ALPG
SCHEMBL6405226 0.83 TP53 (0.56) ALDH1A1ALOX15TSHRHSD17B10KMT2A
SCHEMBL4211069 0.83 ALPG (0.74) ALDH1A1TSHRGAAKMT2AMEN1
SCHEMBL6410833 0.81 CYP3A4 (0.76) ALDH1A1TSHRGAAKMT2AMEN1
SCHEMBL6405231 0.81 TSHR (0.68) ALDH1A1ALOX15TSHRHSD17B10GAA
SCHEMBL4209535 0.81 ALPG (0.74) ALDH1A1ALOX15TSHRHSD17B10GAA

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 720/4885ALOX15 2151/4885TSHR 3470/4885

“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.