SCHEMBL13553637

SCHEMBL13553637

CCn1c(=O)c(-c2c(Cl)cc(C3CCN(C(C)=O)CC3)cc2Cl)cc2cnc(Nc3ccc(NC4CCCN(C)C4)cc3)nc21

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ WEE1 P30291 3/20 0.54
▸ FGFR1 P11362 8/20 0.51
▸ EGFR P00533 3/20 0.51
▸ PKN1 Q16512 3/20 0.49
▸ PAK4 O96013 2/20 0.49
▸ PAK1 Q13153 3/20 0.48
▸ SRC P12931 5/20 0.47
▸ ABL1 P00519 3/20 0.47
▸ PDGFRB P09619 3/20 0.47
▸ PDGFRA P16234 3/20 0.47
▸ MAPK14 Q16539 3/20 0.47
▸ KIT P10721 1/20 0.47
▸ PAK3 O75914 2/20 0.43
▸ PAK2 Q13177 2/20 0.43
▸ JAK3 P52333 1/20 0.43
▸ FGFR2 P21802 2/20 0.42
▸ FGFR4 P22455 2/20 0.42
▸ FGFR3 P22607 2/20 0.42

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
SCHEMBL14681982 0.91 WEE1 (0.47) WEE1FGFR1PKN1PAK4SRC
SCHEMBL15787829 0.85 PKN1 (0.56) WEE1FGFR1EGFRPKN1PAK4
SCHEMBL13553495 0.79 PKN1 (0.51) WEE1FGFR1EGFRPKN1PAK4
SCHEMBL14682007 0.79 PAK1 (0.52) WEE1FGFR1EGFRPKN1PAK4
SCHEMBL15787974 0.78 WEE1 (0.57) WEE1FGFR1EGFRPKN1PAK4
SCHEMBL13553533 0.78 PKN1 (0.66) WEE1FGFR1EGFRPKN1PAK4
SCHEMBL14682082 0.76 JAK3 (0.47) FGFR1PKN1PAK4SRCJAK3
SCHEMBL15787987 0.74 PKN1 (0.51) WEE1FGFR1EGFRPKN1PAK4
SCHEMBL13553685 0.74 PAK1 (0.51) WEE1FGFR1EGFRPKN1PAK4
SCHEMBL13553531 0.74 PKN1 (0.76) WEE1FGFR1EGFRPKN1PAK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8372970-B2 8-ethyl-6-(aryl)pyrido[2,3-D]pyrimidin-7(8H)-ones for the treatment of CNS disorders AFRAXIS, INC. (US) 2013-02-12 — — US disclosed
US-20120270866-A1 8-ETHYL-6-(ARYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS AFRAXIS INC. (US) 2012-10-25 — — 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-20120270866-A1 8-ETHYL-6-(ARYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS PAK2, PAK6, PAK5 WEE1 850/4885FGFR1 2256/4885EGFR 2012/4885

“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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