SCHEMBL5058357

SCHEMBL5058357

O=c1cc(-c2cccnc2)oc2cc(N3CCOCC3)cc(O)c12

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 3/20 0.77
CCNC P24863 3/20 0.51
CDK8 P49336 3/20 0.51
KDM4E B2RXH2 4/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
PPARG P37231 2/20 0.48
POLH Q9Y253 4/20 0.48
ABCB1 P08183 4/20 0.48
CYP3A4 P08684 4/20 0.48
MAPT P10636 4/20 0.48
CYP2C9 P11712 4/20 0.48
CYP2C19 P33261 4/20 0.48
ABCG2 Q9UNQ0 4/20 0.48
AKR1B10 O60218 3/20 0.48
SLCO2B1 O94956 3/20 0.48
CCNB2 O95067 3/20 0.48
ALDH1A1 P00352 3/20 0.48
TP53 P04637 3/20 0.48
CYP1A1 P04798 3/20 0.48

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
SCHEMBL5063530 0.87 PRKDC (1.00) PRKDCCCNCCDK8KDM4EMEN1
SCHEMBL29492842 0.87 PRKDC (1.00) PRKDCCCNCCDK8KDM4EMEN1
SCHEMBL7092594 0.83 PRKDC (0.91) PRKDCCCNCCDK8KDM4EMEN1
SCHEMBL5054842 0.80 PRKDC (0.74) PRKDCCCNCCDK8KDM4EMEN1
SCHEMBL5063525 0.78 PRKDC (0.74) PRKDCCCNCCDK8KDM4EMEN1
SCHEMBL5055259 0.78 PRKDC (0.74) PRKDCCCNCCDK8MEN1KMT2A
SCHEMBL28762682 0.78 PRKDC (0.81) PRKDCCCNCCDK8KDM4EMEN1
SCHEMBL9199822 0.77 AR (0.69) CCNCCDK8KDM4EMEN1KMT2A
SCHEMBL5058392 0.77 PRKDC (0.80) PRKDCCCNCCDK8KDM4EMEN1
SCHEMBL5453460 0.71 PRKDC (0.63) PRKDCPIK3CAPIK3CBPIK3CGPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1351946-A2 MATERIALS AND METHODS TO POTENTIATE CANCER TREATMENT ICOS CORPORATION (US) 2003-10-15 EP claimed
US-20020165218-A1 Materials and methods to potentiate cancer treatment LUITPOLD PHARMACEUTICALS, INC. 2002-11-07 US claimed
WO-2002020500-A2 MATERIALS AND METHODS TO POTENTIATE CANCER TREATMENT ICOS CORPORATION (US) 2002-03-14 WO claimed
US-8242115-B2 Inhibit DNA-dependent protein kinase; reduced side effects caused by radiation and chemotherapy drugs LUITPOLD PHARMACEUTICALS, INC. (US) 2012-08-14 US disclosed
US-8242115-B2 Inhibit DNA-dependent protein kinase; reduced side effects caused by radiation and chemotherapy drugs LUITPOLD PHARMACEUTICALS, INC. (US) 2012-08-14 US disclosed
US-8242115-B2 Inhibit DNA-dependent protein kinase; reduced side effects caused by radiation and chemotherapy drugs LUITPOLD PHARMACEUTICALS, INC. (US) 2012-08-14 US disclosed
US-20080090782-A1 Materials and methods to potentiate cancer treatment LUITPOLD PHARMACEUTICALS, INC. (US) 2008-04-17 US disclosed
US-20080090782-A1 Materials and methods to potentiate cancer treatment LUITPOLD PHARMACEUTICALS, INC. (US) 2008-04-17 US disclosed
US-20080090782-A1 Materials and methods to potentiate cancer treatment LUITPOLD PHARMACEUTICALS, INC. (US) 2008-04-17 US disclosed
US-7179912-B2 Materials and methods to potentiate cancer treatment ICOS CORPORATION (US) 2007-02-20 US disclosed
US-7179912-B2 Materials and methods to potentiate cancer treatment ICOS CORPORATION (US) 2007-02-20 US disclosed
US-7179912-B2 Materials and methods to potentiate cancer treatment ICOS CORPORATION (US) 2007-02-20 US disclosed
EP-1351946-A2 MATERIALS AND METHODS TO POTENTIATE CANCER TREATMENT ICOS CORPORATION (US) 2003-10-15 EP disclosed
US-20020165218-A1 Materials and methods to potentiate cancer treatment LUITPOLD PHARMACEUTICALS, INC. 2002-11-07 US disclosed
WO-2002020500-A2 MATERIALS AND METHODS TO POTENTIATE CANCER TREATMENT ICOS CORPORATION (US) 2002-03-14 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 (2 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-20080090782-A1 Materials and methods to potentiate cancer treatment DCK, CHEK2, CHEK1 PRKDC 17/4885CCNC 195/4885CDK8 235/4885
US-20020165218-A1 Materials and methods to potentiate cancer treatment DCK, CHEK2, CHEK1 PRKDC 17/4885CCNC 195/4885CDK8 235/4885

“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.