SCHEMBL5444162

SCHEMBL5444162

O=C(c1ccncc1)n1c2ccccc2c(=O)c2c(O)cc(N3CCOCC3)cc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 3/20 0.58
PLOD2 O00469 2/20 0.45
PLOD3 O60568 2/20 0.45
PLOD1 Q02809 2/20 0.45
P2RX4 Q99571 1/20 0.43
MAPT P10636 3/20 0.41
PIK3C2B O00750 4/20 0.41
PIK3CD O00329 1/20 0.40
PIK3CA P42336 1/20 0.40
PIK3CB P42338 1/20 0.40
PIK3CG P48736 1/20 0.40
CYP2C19 P33261 2/20 0.39
CYP2C9 P11712 1/20 0.39
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
KMO O15229 1/20 0.37
KHK P50053 1/20 0.36
USP2 O75604 1/20 0.36

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
SCHEMBL5440733 0.92 PRKDC (0.65) PRKDCP2RX4MAPTPIK3C2BPIK3CD
SCHEMBL5444170 0.90 PRKDC (0.55) PRKDCPLOD2PLOD3PLOD1P2RX4
SCHEMBL5440678 0.81 PRKDC (0.61) PRKDCMAPTPIK3C2BPIK3CDPIK3CA
SCHEMBL14802160 0.78 PRKDC (0.68) PRKDCMAPTPIK3C2BPIK3CDPIK3CA
SCHEMBL5444182 0.73 PRKDC (1.00) PRKDCP2RX4MAPTPIK3C2BPIK3CD
SCHEMBL5454434 0.71 MGAM (0.63) PRKDC
SCHEMBL5440644 0.69 PRKDC (0.55) PRKDCMAPTPIK3C2BPIK3CDPIK3CA
SCHEMBL5446315 0.67 MAOA (0.64) PRKDCMAPT
SCHEMBL5442834 0.67 PRKDC (0.48) PRKDCPLOD2PLOD3PLOD1MAPT
SCHEMBL29754967 0.66 CYP2C9 (0.45) P2RX4MAPTCYP2C9HTTSMN1; SMN2

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 6 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

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.