SCHEMBL16520565

SCHEMBL16520565

CCOC(=O)c1cc(C)nn1CC(=O)c1ccc(Br)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.50
▸ RAB9A P51151 3/20 0.49
▸ KMT2A Q03164 4/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ ELANE P08246 2/20 0.43
▸ MAPT P10636 5/20 0.42
▸ ATM Q13315 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ MGAM O43451 1/20 0.41
▸ AMY1A P0DUB6 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ SI P14410 1/20 0.41
▸ MGAM2 Q2M2H8 1/20 0.41
▸ IDO1 P14902 1/20 0.41
▸ SIRT2 Q8IXJ6 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ HTT P42858 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL15287410 0.85 RAB9A (0.47) POLBRAB9AKMT2AMEN1MAPT
SCHEMBL15287416 0.85 POLB (0.46) POLBRAB9AKMT2AMEN1ELANE
SCHEMBL16427759 0.82 PDE4B (0.50) POLBKMT2AMEN1MAPTALDH1A1
SCHEMBL13170000 0.78 SMN1; SMN2 (0.46) POLBRAB9AKMT2AMAPTALDH1A1
SCHEMBL1198071 0.78 LMNA (0.58) POLBRAB9AKMT2AMAPTALDH1A1
SCHEMBL22449668 0.78 LMNA (0.40) POLBRAB9AKMT2AMEN1MAPT
SCHEMBL15527407 0.77 NHERF1 (0.44) RAB9AKMT2AMEN1ELANEMAPT
SCHEMBL7373266 0.76 SMN1; SMN2 (0.51) POLBKMT2AMEN1ELANEMAPT
SCHEMBL6188814 0.76 MAPT (0.52) POLBRAB9AKMT2AMAPTALDH1A1
SCHEMBL23112586 0.76 MAPT (0.41) POLBRAB9AKMT2AMEN1ELANE

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-9120805-B2 Substituted pyrrolo[1,2-A]pyrazin-1-ones and pyrazolo[1,5-A]pyrazin-4-ones as inhibitors of tankyrase and poly(ADP-ribose)polymerase activity MERCK PATENT GMBH (DE) 2015-09-01 — — US disclosed
US-20150057264-A1 BICYCLIC PYRAZINONE DERIVATIVES MERCK PATENT GMBH (DE) 2015-02-26 — — 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-20150057264-A1 BICYCLIC PYRAZINONE DERIVATIVES TNKS, TPI1, TBKBP1 POLB 1499/4885RAB9A 3894/4885KMT2A 2319/4885

“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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