SCHEMBL10323114

SCHEMBL10323114

COC(=O)c1ccc(C)c(NC(=O)c2cc3cnc(NCC4COC(C)(C)O4)cc3[nH]c2=O)c1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 13/20 0.54
▸ DYRK1B Q9Y463 11/20 0.54
▸ HTT P42858 1/20 0.37
▸ MAPK14 Q16539 1/20 0.37
▸ BUB1 O43683 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL11890480 0.93 DYRK1A (0.45) DYRK1ADYRK1BHTTBUB1ALDH1A1
SCHEMBL10322550 0.89 RAB9A (0.41) DYRK1ADYRK1BBUB1ALDH1A1POLB
SCHEMBL10322294 0.86 BUB1 (0.39) DYRK1ADYRK1BHTTBUB1ALDH1A1
SCHEMBL10322375 0.80 BUB1 (0.41) MAPK14BUB1ALDH1A1POLBSMN1; SMN2
SCHEMBL10322224 0.80 DYRK1A (0.59) DYRK1ADYRK1BMAPK14ALDH1A1POLB
SCHEMBL10321271 0.77 DYRK1A (0.72) DYRK1ADYRK1BMAPK14ALDH1A1
SCHEMBL10322440 0.73 DYRK1A (0.61) DYRK1ADYRK1BMAPK14ALDH1A1SMN1; SMN2
SCHEMBL10322166 0.73 BUB1 (0.38) DYRK1ADYRK1BBUB1ALDH1A1SMN1; SMN2
SCHEMBL10318281 0.71 DYRK1A (1.00) DYRK1ADYRK1BMAPK14ALDH1A1
SCHEMBL10321365 0.71 DYRK1A (0.80) DYRK1ADYRK1BHTTMAPK14ALDH1A1

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
WO-2012098066-A1 1,6- AND 1,8-NAPHTHYRIDINES USEFUL AS DYRK1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 — — WO disclosed
US-20120184562-A1 1,6- AND 1,8-NAPHTHYRIDINES LUK KIN-CHUN (US) 2012-07-19 — — US disclosed
US-20120184562-A1 1,6- AND 1,8-NAPHTHYRIDINES LUK KIN-CHUN (US) 2012-07-19 — — US disclosed
US-20120184562-A1 1,6- AND 1,8-NAPHTHYRIDINES LUK KIN-CHUN (US) 2012-07-19 — — 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-20120184562-A1 1,6- AND 1,8-NAPHTHYRIDINES PSEN1, BRCA1, PSEN2 DYRK1A 1366/4885DYRK1B 2109/4885HTT 78/4885

“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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