SCHEMBL1284479

SCHEMBL1284479

NC(=O)CC(n1ccc2cnc(Nc3ccc4[nH]ncc4c3)nc21)C1(C(=O)O)CCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 6/20 0.44
▸ JAK3 P52333 4/20 0.44
▸ ROCK2 O75116 7/20 0.41
▸ ROCK1 Q13464 3/20 0.41
▸ IRAK4 Q9NWZ3 2/20 0.41
▸ PLK4 O00444 1/20 0.41
▸ CHEK1 O14757 1/20 0.41
▸ MAPK13 O15264 1/20 0.41
▸ PDPK1 O15530 1/20 0.41
▸ DAPK3 O43293 1/20 0.41
▸ DYRK3 O43781 1/20 0.41
▸ JAK2 O60674 1/20 0.41
▸ PRKD3 O94806 1/20 0.41
▸ MAP4K4 O95819 1/20 0.41
▸ PAK4 O96013 1/20 0.41
▸ CHEK2 O96017 1/20 0.41
▸ ABL1 P00519 1/20 0.41
▸ EGFR P00533 1/20 0.41
▸ ERBB2 P04626 1/20 0.41
▸ NTRK1 P04629 1/20 0.41

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
SCHEMBL1284702 0.84 SYK (0.42) SYKJAK3ROCK2ROCK1IRAK4
SCHEMBL1284762 0.83 SYK (0.41) SYKJAK3IRAK4JAK2EGFR
SCHEMBL1285558 0.83 CDK4 (0.45) SYKJAK3ROCK2ROCK1IRAK4
SCHEMBL1284954 0.82 SYK (0.42) SYKJAK3JAK2CDK1CDK2
SCHEMBL1284750 0.82 MAP3K5 (0.46) JAK3JAK2ABL1EGFRSRC
SCHEMBL1284926 0.81 CDK4 (0.40) EGFRFGFR1CDK2MARK3KDR
SCHEMBL1285070 0.81 CDK4 (0.45) SYKJAK3ROCK2ROCK1IRAK4
SCHEMBL1284416 0.81 JAK3 (0.49) SYKJAK3ROCK2DAPK3JAK2
SCHEMBL1284236 0.81 JAK3 (0.35) JAK3JAK2CDK1SRCCDK2
SCHEMBL1284506 0.80 CAMK2D (0.43) JAK3JAK2EGFRCDK1CSF1R

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-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 SYK 230/4885JAK3 20/4885ROCK2 165/4885

“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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