SCHEMBL5267935

SCHEMBL5267935

COc1cc(C(=O)NCC(=O)O)ccc1-c1nc2c(c(-c3ccccc3)nn2C)c(=O)[nH]1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 2/20 0.43
PDE5A O76074 6/20 0.42
ROCK2 O75116 9/20 0.41
ROCK1 Q13464 9/20 0.41
LMNA P02545 2/20 0.40
TP53 P04637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MAPT P10636 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
SCHEMBL5234072 0.91 RXFP1 (0.49) PDE7APDE5AROCK2ROCK1
SCHEMBL5230203 0.88 PDE7A (0.48) PDE7APDE5ALMNAMAPT
SCHEMBL5234200 0.84 PDE5A (0.46) PDE7APDE5A
SCHEMBL5230086 0.82 PDE7A (0.67) PDE7A
SCHEMBL5230077 0.82 PDE7A (0.49) PDE7APDE5A
SCHEMBL5230296 0.82 ALDH1A1 (0.48) PDE7APDE5AROCK2MAPT
SCHEMBL5228648 0.81 PDE5A (0.53) PDE7APDE5A
SCHEMBL5228324 0.81 PDE7A (0.48) PDE7APDE5A
SCHEMBL5233971 0.80 PDE5A (0.54) PDE7APDE5ANPSR1
SCHEMBL5231866 0.80 PDE5A (0.45) PDE7APDE5A

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
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 PDE7A 4/4885PDE5A 8/4885ROCK2 922/4885

“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.