SCHEMBL10322342

SCHEMBL10322342

COC(=O)c1cccc(NC(=O)c2cc3cnc(N4CCN(C)CC4)cc3[nH]c2=O)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.47
▸ AKT1 P31749 1/20 0.45
▸ RAB9A P51151 4/20 0.44
▸ ROCK2 O75116 2/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ LIMK1 P53667 2/20 0.43
▸ LIMK2 P53671 2/20 0.43
▸ DYRK1A Q13627 3/20 0.42
▸ DYRK1B Q9Y463 3/20 0.42
▸ FAAH O00519 1/20 0.42
▸ CREBBP Q92793 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ FGFR1 P11362 1/20 0.41
▸ MAPT P10636 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
SCHEMBL10322440 0.85 DYRK1A (0.61) RAB9AL3MBTL1DYRK1ADYRK1BALDH1A1
SCHEMBL10323421 0.85 POLB (0.48) POLBAKT1RAB9AROCK2L3MBTL1
SCHEMBL10322753 0.85 DYRK1A (0.61) DYRK1ADYRK1BALDH1A1TSHR
SCHEMBL10322494 0.83 KMT2A (0.47) RAB9AL3MBTL1ALDH1A1
SCHEMBL10321615 0.82 RAB9A (0.50) RAB9AL3MBTL1DYRK1ADYRK1BCREBBP
SCHEMBL10322954 0.76 HTR3A (0.46) POLBRAB9AL3MBTL1ALDH1A1
SCHEMBL10330656 0.76 GPR17 (0.54) POLBRAB9AL3MBTL1DYRK1ADYRK1B
SCHEMBL10322470 0.75 RAB9A (0.43) POLBRAB9AL3MBTL1DYRK1ADYRK1B
SCHEMBL10446504 0.73 DYRK1A (0.53) POLBRAB9AL3MBTL1DYRK1ADYRK1B
SCHEMBL10322550 0.73 RAB9A (0.41) POLBRAB9AL3MBTL1LIMK2DYRK1A

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 POLB 517/4885AKT1 3683/4885RAB9A 559/4885

“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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