SCHEMBL14239232

SCHEMBL14239232

COC(=O)[C@@H](C)NCC(=O)Nc1cccc2c1C(=O)c1cccc(NC(=O)CN[C@H](C)C(=O)OC)c1C2=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TERT O14746 10/20 0.53
PTPRC P08575 1/20 0.52
PTPN13 Q12923 1/20 0.52
MAOA P21397 1/20 0.51
MAPT P10636 3/20 0.49
MEN1 O00255 2/20 0.49
ALDH1A1 P00352 2/20 0.49
KMT2A Q03164 2/20 0.49
POLB P06746 1/20 0.49
GAA P10253 1/20 0.49
DNMT1 P26358 1/20 0.49
RAD52 P43351 1/20 0.49
SMARCA2 P51531 1/20 0.49
NPC1 O15118 1/20 0.47
MAPK1 P28482 1/20 0.47
RAB9A P51151 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL14240478 1.00 TERT (0.53) TERTPTPRCPTPN13MAOAMAPT
SCHEMBL12110542 0.96 TERT (0.54) TERTPTPRCPTPN13MAOAMAPT
SCHEMBL14239610 0.91 TERT (0.52) TERTPTPRCPTPN13MAOAMAPT
SCHEMBL12111924 0.90 TERT (0.48) TERTPTPRCPTPN13MAOAMAPT
SCHEMBL14239287 0.88 TERT (0.51) TERTPTPRCPTPN13MAOAMAPT
SCHEMBL14240229 0.88 TERT (0.51) TERTPTPRCPTPN13MAOAMAPT
SCHEMBL14239233 0.85 TERT (0.49) TERTPTPRCPTPN13MAOAMAPT
SCHEMBL12110592 0.84 TERT (0.52) TERTPTPRCPTPN13MAOAMAPT
SCHEMBL12110536 0.82 TERT (0.50) TERTPTPRCPTPN13MAOAMAPT
SCHEMBL1305106 0.81 TERT (0.60) TERTPTPRCPTPN13MAOAMAPT

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 2376/4885PTPRC 4400/4885PTPN13 4825/4885

“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.