SCHEMBL5446334

SCHEMBL5446334

O=c1c2ccc(OCCO)cc2oc2cc(N3CCOCC3)cc(O)c12

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 9/20 0.51
XDH P47989 3/20 0.45
BCL9 O00512 1/20 0.45
CTNNB1 P35222 1/20 0.45
P2RY12 Q9H244 1/20 0.44
ALDH2 P05091 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43

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
SCHEMBL14802156 0.91 PRKDC (0.59) PRKDCXDHP2RY12
SCHEMBL5441507 0.89 PRKDC (0.47) PRKDCXDHP2RY12
SCHEMBL14447683 0.88 PRKDC (0.46) PRKDCXDHP2RY12
SCHEMBL5454078 0.87 PRKDC (0.50) PRKDCXDHALDH2
SCHEMBL14802151 0.87 PRKDC (0.46) PRKDCXDHP2RY12
SCHEMBL14802154 0.87 PRKDC (0.46) PRKDCXDHP2RY12
SCHEMBL14802144 0.86 ALDH1A1 (0.47) PRKDCP2RY12
SCHEMBL5444190 0.85 PRKDC (0.56) PRKDCMAOAMAOB
SCHEMBL14802153 0.85 PRKDC (0.61) PRKDC
SCHEMBL14447672 0.85 TSHR (0.49) PRKDCP2RY12

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 12/4885XDH 68/4885BCL9 2935/4885

“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.