SCHEMBL13453041

SCHEMBL13453041

Cc1ccc2c(c1)CN(Cc1nccn1C)CC2

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.44
PRMT5 O14744 2/20 0.41
WDR77 Q9BQA1 2/20 0.41
POLB P06746 3/20 0.41
ALDH1A1 P00352 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
ATM Q13315 3/20 0.40
LMNA P02545 1/20 0.39
CD44 P16070 1/20 0.39
EGLN1 Q9GZT9 4/20 0.39
EGLN3 Q9H6Z9 1/20 0.38
DRD2 P14416 1/20 0.37
DRD4 P21917 1/20 0.37
DRD3 P35462 1/20 0.37

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
SCHEMBL6963099 0.81 PRMT5 (0.41) PRMT5WDR77EGLN1DRD2DRD4
SCHEMBL20983969 0.76 CHRM5 (0.37) TDP1PRMT5WDR77POLBALDH1A1
SCHEMBL13453360 0.74 ALOX15 (0.51) PRMT5WDR77POLBALDH1A1MEN1
SCHEMBL6369524 0.73 HRH3 (0.51) PRMT5POLBMEN1KMT2AATM
SCHEMBL17996825 0.72 EGLN1 (0.48) TDP1POLBALDH1A1NPSR1L3MBTL1
SCHEMBL17305900 0.72 EGLN1 (0.48) TDP1POLBALDH1A1NPSR1L3MBTL1
SCHEMBL13453039 0.72 MEN1 (0.47) TDP1PRMT5POLBMEN1KMT2A
SCHEMBL1331195 0.71 EGLN1 (0.45) TDP1POLBALDH1A1NPSR1L3MBTL1
SCHEMBL17888434 0.71 EGLN1 (0.45) TDP1POLBALDH1A1NPSR1L3MBTL1
SCHEMBL14348644 0.70 SIGMAR1 (0.45) POLBMEN1KMT2AATMLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1966191-B1 SUBSTITUTED PYRAZINONE DERIVATIVES AS ALPHA2C-ADRENORECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2010-03-17 EP disclosed
US-20080269251-A1 Substituted Pyrazinone Derivatives as Alpha2C-Adrenoreceptor Antagonists ANDRE-GIL JOSE IGNACIO 2008-10-30 US disclosed
US-20080269251-A1 Substituted Pyrazinone Derivatives as Alpha2C-Adrenoreceptor Antagonists ANDRE-GIL JOSE IGNACIO 2008-10-30 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-20080269251-A1 Substituted Pyrazinone Derivatives as Alpha2C-Adrenoreceptor Antagonists ADRA2C, ADRB2, ADRA2A TDP1 2208/4885PRMT5 2057/4885WDR77 3081/4885

“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.