SCHEMBL14809729

SCHEMBL14809729

CNC(=O)c1cc(-c2ccc(-c3cc4cnc(Nc5ccc(C6CCN(C)CC6)cc5)nc4n(C)c3=O)c(Cl)c2)ccn1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PKN1 Q16512 3/20 0.58
▸ PAK4 O96013 2/20 0.58
▸ SRC P12931 6/20 0.49
▸ ABL1 P00519 4/20 0.49
▸ PDGFRB P09619 4/20 0.49
▸ PDGFRA P16234 4/20 0.49
▸ MAPK14 Q16539 4/20 0.49
▸ KIT P10721 1/20 0.49
▸ FGFR1 P11362 5/20 0.48
▸ FGFR2 P21802 1/20 0.48
▸ FGFR4 P22455 1/20 0.48
▸ FGFR3 P22607 1/20 0.48
▸ PAK1 Q13153 3/20 0.47
▸ PAK3 O75914 2/20 0.47
▸ PAK2 Q13177 2/20 0.47
▸ MAP4K1 Q92918 4/20 0.46
▸ STK4 Q13043 1/20 0.45
▸ STK3 Q13188 1/20 0.45
▸ SIK2 Q9H0K1 1/20 0.45
▸ STK26 Q9P289 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
SCHEMBL15030441 0.92 PKN1 (0.69) PKN1PAK4FGFR1PAK1PAK3
SCHEMBL15030228 0.92 PAK4 (0.49) PKN1PAK4SRCABL1PDGFRB
SCHEMBL14824652 0.88 PAK4 (0.51) PKN1PAK4MAP4K1SIK2WEE1
SCHEMBL14824629 0.87 PKN1 (0.62) PKN1PAK4FGFR1FGFR4PAK1
SCHEMBL15030449 0.86 PKN1 (0.70) PKN1PAK4FGFR1FGFR4PAK1
SCHEMBL15036498 0.85 PKN1 (0.71) PKN1PAK4FGFR1PAK1PAK3
SCHEMBL15030210 0.85 PKN1 (0.59) PKN1PAK4FGFR1FGFR4PAK1
SCHEMBL14824621 0.84 PKN1 (0.63) PKN1PAK4SRCABL1PDGFRB
SCHEMBL15030204 0.83 PKN1 (0.62) PKN1PAK4SRCABL1PDGFRB
SCHEMBL15035161 0.83 PAK4 (0.64) PKN1PAK4SRCABL1PDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140163026-A1 8-ETHYL-6-(ARYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF NERVOUS SYSTEM DISORDERS AND CANCER AFRAXIS HOLDINGS, INC. (US) 2014-06-12 — — US disclosed
US-20140163026-A1 8-ETHYL-6-(ARYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF NERVOUS SYSTEM DISORDERS AND CANCER AFRAXIS HOLDINGS, INC. (US) 2014-06-12 — — US disclosed
EP-2694504-A2 8-ETHYL-6-(ARYL)PYRIDO [2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF NERVOUS SYSTEM DISORDERS AND CANCER Afraxis Holdings, Inc. (US) 2014-02-12 — — EP disclosed
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER AFRAXIS, INC. (US) 2013-06-20 — — US disclosed
WO-2013086451-A2 PAK INHIBITORS FOR THE TREATMENT OF CANCER AFRAXIS, INC. (US) 2013-06-13 — — WO disclosed
WO-2013043232-A2 8-ETHYL-6-(ARYL)PYRIDO [2,3-D]PYRIMIDIN-7(8H) -ONES FOR THE TREATMENT OF NERVOUS SYSTEM DISORDERS AND CANCER AFRAXIS, INC. (US) 2013-03-28 — — WO disclosed
WO-2013043232-A2 8-ETHYL-6-(ARYL)PYRIDO [2,3-D]PYRIMIDIN-7(8H) -ONES FOR THE TREATMENT OF NERVOUS SYSTEM DISORDERS AND CANCER AFRAXIS, INC. (US) 2013-03-28 — — 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-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 PKN1 326/4885PAK4 5/4885SRC 26/4885
US-20140163026-A1 8-ETHYL-6-(ARYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF NERVOUS SYSTEM DISORDERS AND CANCER PAK2, PAK1, PAK6 PKN1 182/4885PAK4 5/4885SRC 115/4885

“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.

Send feedback