SCHEMBL5444170

SCHEMBL5444170

O=C(c1cccnc1)n1c2ccccc2c(=O)c2c(O)cc(N3CCOCC3)cc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 4/20 0.55
PLOD2 O00469 2/20 0.48
PLOD3 O60568 2/20 0.48
PLOD1 Q02809 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.45
TP53 P04637 1/20 0.45
PIK3CA P42336 3/20 0.41
PIK3CB P42338 2/20 0.41
PIK3CG P48736 2/20 0.41
PIK3CD O00329 1/20 0.41
P2RX4 Q99571 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PIK3C2B O00750 2/20 0.39
MAPT P10636 1/20 0.39
KHK P50053 1/20 0.39
PIK3R2 O00459 1/20 0.38
KMO O15229 1/20 0.38
POLB P06746 1/20 0.37
MTOR P42345 1/20 0.37

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
SCHEMBL5444162 0.90 PRKDC (0.58) PRKDCPLOD2PLOD3PLOD1SMN1; SMN2
SCHEMBL5440733 0.89 PRKDC (0.65) PRKDCSMN1; SMN2PIK3CAPIK3CBPIK3CG
SCHEMBL5440678 0.79 PRKDC (0.61) PRKDCPIK3CAPIK3CBPIK3CGPIK3CD
SCHEMBL14802160 0.76 PRKDC (0.68) PRKDCSMN1; SMN2PIK3CAPIK3CBPIK3CG
SCHEMBL5444182 0.71 PRKDC (1.00) PRKDCSMN1; SMN2PIK3CAPIK3CBPIK3CD
SCHEMBL5058614 0.69 PRKDC (0.73) PRKDCPLOD2PLOD3PLOD1SMN1; SMN2
SCHEMBL5442834 0.69 PRKDC (0.48) PRKDCPLOD2PLOD3PLOD1SMN1; SMN2
SCHEMBL5454434 0.69 MGAM (0.63) PRKDCPOLB
SCHEMBL5058357 0.67 PRKDC (0.77) PRKDCSMN1; SMN2TP53PIK3CAPIK3CB
SCHEMBL5440644 0.67 PRKDC (0.55) PRKDCSMN1; SMN2PIK3CAPIK3CBPIK3CG

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8404681-B2 Xanthones, thioxanthones and acridinones as DNA-PK inhibitors LUITPOLD PHARMACEUTICALS, INC. (US) 2013-03-26 US disclosed
US-8404681-B2 Xanthones, thioxanthones and acridinones as DNA-PK inhibitors LUITPOLD PHARMACEUTICALS, INC. (US) 2013-03-26 US disclosed
US-8404681-B2 Xanthones, thioxanthones and acridinones as DNA-PK inhibitors LUITPOLD PHARMACEUTICALS, INC. (US) 2013-03-26 US disclosed
US-20070167441-A1 Xanthones, thioxanthones and acridinones as dna-pk inhibitors LUITPOLD PHARMACEUTICALS, INC. 2007-07-19 US disclosed
US-20070167441-A1 Xanthones, thioxanthones and acridinones as dna-pk inhibitors LUITPOLD PHARMACEUTICALS, INC. 2007-07-19 US disclosed
US-20070167441-A1 Xanthones, thioxanthones and acridinones as dna-pk inhibitors LUITPOLD PHARMACEUTICALS, INC. 2007-07-19 US disclosed
EP-1660473-A2 XANTHONES, THIOXANTHONES AND ACRIDINONES AS DNA-PK INHIBITORS Luitpold Pharmaceuticals, Inc. (US) 2006-05-31 EP disclosed
WO-2004085418-A2 XANTHONES, THIOXANTHONES AND ACRIDINONES AS DNA-PK INHIBITORS LUITPOLD PHARMACEUTICALS, INC. (US) 2004-10-07 WO 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-20070167441-A1 Xanthones, thioxanthones and acridinones as dna-pk inhibitors DCK, DTYMK, XPA PRKDC 12/4885PLOD2 4641/4885PLOD3 4567/4885

“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.