SCHEMBL14811121

SCHEMBL14811121

CCn1c(=O)c(-c2ccc(C(=N)NO)cc2Cl)cc2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc21

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PAK1 Q13153 5/20 0.78
▸ PKN1 Q16512 4/20 0.78
▸ PAK4 O96013 3/20 0.78
▸ WEE1 P30291 1/20 0.69
▸ PAK3 O75914 3/20 0.69
▸ PAK2 Q13177 3/20 0.69
▸ FGFR1 P11362 5/20 0.57
▸ SRC P12931 3/20 0.57
▸ FGFR2 P21802 1/20 0.57
▸ FGFR4 P22455 1/20 0.57
▸ FGFR3 P22607 1/20 0.57
▸ CDK4 P11802 4/20 0.56
▸ CCND1 P24385 4/20 0.56
▸ CCND2 P30279 4/20 0.56
▸ CCND3 P30281 4/20 0.56
▸ LIMK1 P53667 1/20 0.52
▸ LIMK2 P53671 1/20 0.52
▸ EGFR P00533 2/20 0.49
▸ TNK2 Q07912 2/20 0.49
▸ PDGFRB P09619 2/20 0.49

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
SCHEMBL15787998 0.92 PAK1 (0.79) PAK1PKN1PAK4WEE1PAK3
SCHEMBL14824620 0.90 PAK1 (0.70) PAK1PKN1PAK4WEE1PAK3
SCHEMBL1680912 0.89 PAK1 (0.79) PAK1PKN1PAK4WEE1PAK3
SCHEMBL1680836 0.89 PAK1 (0.79) PAK1PKN1PAK4WEE1PAK3
SCHEMBL14811122 0.88 PAK1 (0.78) PAK1PKN1PAK4WEE1PAK3
SCHEMBL1680969 0.88 PAK1 (0.85) PAK1PKN1PAK4WEE1PAK3
SCHEMBL14824809 0.86 PAK1 (0.74) PAK1PKN1PAK4WEE1PAK3
SCHEMBL15030437 0.85 PAK1 (0.73) PAK1PKN1PAK4WEE1PAK3
SCHEMBL13554095 0.85 PAK1 (0.80) PAK1PKN1PAK4WEE1PAK3
SCHEMBL9987954 0.84 PAK1 (0.81) PAK1PKN1PAK4WEE1PAK3

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-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
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
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 (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-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 PAK1 2/4885PKN1 182/4885PAK4 5/4885

“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.

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