SCHEMBL14239231

SCHEMBL14239231

COC(=O)[C@H](CC(C)C)NCC(=O)Nc1ccc(NC(=O)CN[C@H](CC(C)C)C(=O)OC)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TERT O14746 8/20 0.48
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
PTPRC P08575 1/20 0.44
PTPN13 Q12923 1/20 0.44
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
LMNA P02545 1/20 0.41
BIRC2 Q13490 1/20 0.39

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
SCHEMBL14239233 0.92 TERT (0.49) TERTMEN1KMT2APTPRCPTPN13
SCHEMBL12110536 0.88 TERT (0.50) TERTMEN1KMT2APTPRCPTPN13
SCHEMBL14239610 0.85 TERT (0.52) TERTMEN1KMT2APTPRCPTPN13
SCHEMBL14240029 0.83 TERT (0.50) TERTMEN1KMT2APTPRCPTPN13
SCHEMBL14240483 0.78 TERT (0.56) TERTMEN1KMT2APTPRCPTPN13
SCHEMBL14151673 0.78 TERT (0.52) TERTMEN1KMT2APTPRCPTPN13
SCHEMBL14240478 0.77 TERT (0.53) TERTMEN1KMT2APTPRCPTPN13
SCHEMBL14239232 0.77 TERT (0.53) TERTMEN1KMT2APTPRCPTPN13
SCHEMBL14240031 0.76 PTPRC (0.58) TERTMEN1KMT2APTPRCPTPN13
SCHEMBL13343847 0.75 ALDH1A1 (0.48) TERTMEN1KMT2APTPRCPTPN13

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-20120316234-A1 ANTHRAQUINONE -BASED COMPOUND, THE SYNTHESIS PROCESSES AND THE APPLICATION THEREOF NATIONAL DEFENSE MEDICAL CENTER (TW) 2012-12-13 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-20120316234-A1 ANTHRAQUINONE -BASED COMPOUND, THE SYNTHESIS PROCESSES AND THE APPLICATION THEREOF AAAS, QPCT, NQO2 TERT 2376/4885MEN1 2110/4885KMT2A 301/4885

“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.