SCHEMBL1285257

SCHEMBL1285257

CN1CCc2ccc(Nc3ncc4ccn(C(CC(N)=O)C5(C(=O)O)CCC5)c4n3)cc2C1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 1/20 0.43
▸ SYK P43405 1/20 0.42
▸ TNK2 Q07912 2/20 0.42
▸ BTK Q06187 3/20 0.42
▸ WEE1 P30291 6/20 0.41
▸ ULK1 O75385 3/20 0.40
▸ ULK2 Q8IYT8 3/20 0.40
▸ PLK1 P53350 1/20 0.40
▸ AXL P30530 2/20 0.39
▸ JAK3 P52333 1/20 0.39
▸ NTRK1 P04629 1/20 0.39
▸ CSF1R P07333 1/20 0.39
▸ KIT P10721 1/20 0.39
▸ SRC P12931 1/20 0.39
▸ FLT3 P36888 1/20 0.39

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
SCHEMBL1284285 0.87 CDK4 (0.51) JAK3CSF1RSRC
SCHEMBL1284832 0.86 JAK3 (0.38) WEE1PLK1JAK3SRC
SCHEMBL1285557 0.85 STAT6 (0.48) PTK2JAK3CSF1R
SCHEMBL1285097 0.84 JAK2 (0.38) WEE1PLK1JAK3SRC
SCHEMBL1285380 0.84 JAK3 (0.47) SYKBTKWEE1JAK3SRC
SCHEMBL1284954 0.83 SYK (0.42) SYKJAK3
SCHEMBL1284495 0.83 JAK2 (0.38) WEE1PLK1JAK3SRC
SCHEMBL1284762 0.83 SYK (0.41) SYKJAK3
SCHEMBL1284702 0.82 SYK (0.42) SYKULK1PLK1JAK3NTRK1
SCHEMBL1284416 0.82 JAK3 (0.49) SYKJAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120088753-A1 PYRROLOPYRIMIDINES AND USED AS KINASE INHIBITORS MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2012-04-12 — — US claimed
EP-2403853-A1 PYRROLOPYRIMIDINES USED AS KINASE INHIBITORS Medical Research Council Technology (GB) 2012-01-11 — — EP claimed
US-20120088753-A1 PYRROLOPYRIMIDINES AND USED AS KINASE INHIBITORS MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2012-04-12 — — US disclosed
EP-2403853-A1 PYRROLOPYRIMIDINES USED AS KINASE INHIBITORS Medical Research Council Technology (GB) 2012-01-11 — — EP 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-20120088753-A1 PYRROLOPYRIMIDINES AND USED AS KINASE INHIBITORS MARK3, MAPK8, CDK8 PTK2 183/4885SYK 230/4885TNK2 393/4885

“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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