SCHEMBL5233570

SCHEMBL5233570

COc1ccccc1C(=O)Nc1c(C)nn(C2CCCCC2)c1C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.47
MEN1 O00255 5/20 0.47
MAPT P10636 2/20 0.45
PDE7A Q13946 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
NPC1 O15118 1/20 0.44
AHR P35869 1/20 0.44
RAB9A P51151 1/20 0.44
GFER P55789 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
EGFR P00533 5/20 0.44
BTK Q06187 2/20 0.44

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
SCHEMBL5236948 0.91 KMT2A (0.48) KMT2AMEN1MAPTNPSR1NPC1
SCHEMBL5233620 0.91 KMT2A (0.48) KMT2AMEN1MAPTNPSR1NPC1
SCHEMBL5233613 0.91 KMT2A (0.48) KMT2AMEN1MAPTNPSR1NPC1
SCHEMBL5233782 0.89 USP2 (0.48) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL5233614 0.88 EGFR (0.47) KMT2AMEN1MAPTPDE7AEGFR
SCHEMBL5238446 0.83 PDE7A (0.46) KMT2AMEN1MAPTPDE7ANPSR1
SCHEMBL5232285 0.80 PKM (0.44) MAPTPDE7ANPC1RAB9ASMN1; SMN2
SCHEMBL5235770 0.73 NR3C1 (0.43) PDE7ANPC1RAB9A
SCHEMBL5233410 0.72 PDE7A (0.54) PDE7ANPC1RAB9A
SCHEMBL22394177 0.71 EGFR (0.54) EGFRBTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1454897-B1 PYRAZOLOPYRIMIDINONE DERIVATIVES HAVING PDE7-INHIBITORY ACTIVITY ASUBIO PHARMA CO LTD (JP) 2007-10-10 EP disclosed
EP-1454897-B1 PYRAZOLOPYRIMIDINONE DERIVATIVES HAVING PDE7-INHIBITORY ACTIVITY ASUBIO PHARMA CO LTD (JP) 2007-10-10 EP disclosed
US-7268128-B2 1,3,5-trisubstituted-5-phenyl and 5-pyridyl pyrazolopyrimidinone derivatives having PDE7 inhibiting action AUSBIO PHARMA CO., LTD. (JP) 2007-09-11 US disclosed
US-7268128-B2 1,3,5-trisubstituted-5-phenyl and 5-pyridyl pyrazolopyrimidinone derivatives having PDE7 inhibiting action AUSBIO PHARMA CO., LTD. (JP) 2007-09-11 US disclosed
US-7268128-B2 1,3,5-trisubstituted-5-phenyl and 5-pyridyl pyrazolopyrimidinone derivatives having PDE7 inhibiting action AUSBIO PHARMA CO., LTD. (JP) 2007-09-11 US disclosed
US-20050148604-A1 Pyrazolopyrimidinone derivatives having PDE7 inhibiting action OMEROS CORPORATION 2005-07-07 US disclosed
EP-1454897-A1 PYRAZOLOPYRIMIDINONE DERIVATIVES HAVING PDE7−INHIBITORY ACTIVITY Daiichi Suntory Pharma Co., Ltd. (JP) 2004-09-08 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-20050148604-A1 Pyrazolopyrimidinone derivatives having PDE7 inhibiting action PDE7B, PDE3B, PDE3A KMT2A 4007/4885MEN1 4100/4885MAPT 4356/4885

“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.