SCHEMBL6196402

SCHEMBL6196402

CCCOc1ccc(C(C)=O)cc1C(=O)Nc1c(C(N)=O)n[nH]c1CC

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 3/20 0.51
HDAC1 Q13547 3/20 0.51
HDAC6 Q9UBN7 3/20 0.51
CREBBP Q92793 4/20 0.42
PDE4D Q08499 2/20 0.40
MAPT P10636 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
HTT P42858 1/20 0.36
TERT O14746 1/20 0.36
LCLAT1 Q6UWP7 1/20 0.36
PDE5A O76074 1/20 0.35

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
SCHEMBL6201195 0.95 HDAC8 (0.46) HDAC8HDAC1HDAC6CREBBPPDE4D
SCHEMBL6198749 0.89 ALDH1A1 (0.42) HDAC8HDAC1HDAC6CREBBPMAPT
SCHEMBL6779389 0.78 PDE5A (0.43) HDAC8HDAC1HDAC6CREBBPPDE4D
SCHEMBL2404543 0.76 PDE5A (0.38) TERTPDE5A
SCHEMBL7001104 0.74 BRD4 (0.48) HDAC1HDAC6MAPTSMN1; SMN2ALDH1A1
SCHEMBL6783770 0.71 TERT (0.38) PDE4DPDE4APDE4BPDE4CTERT
SCHEMBL6199773 0.71 HDAC1 (0.43) HDAC8HDAC1HDAC6CREBBPPDE4D
SCHEMBL6202176 0.69 PDE5A (0.43) HDAC8HDAC1HDAC6CREBBPPDE4D
SCHEMBL7163305 0.69 HDAC1 (0.57) HDAC8HDAC1HDAC6CREBBPPDE4D
SCHEMBL6196393 0.69 PTPN11 (0.57) HDAC8HDAC1HDAC6CREBBPSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1372656-B1 PYRAZOLO[4,3-D]PYRIMIDINONE COMPOUNDS AS CGMP PDE INHIBITORS PFIZER LTD (GB) 2005-06-22 EP disclosed
US-6784185-B2 PYRAZOLO(4,3-D) PYRIMIDINONE COMPOUNDS USEFUL AS CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASES (CGMP PDES) INHIBITOR PFIZER INC. 2004-08-31 US disclosed
EP-1372656-A1 PYRAZOLO[4,3-D]PYRIMIDINONE COMPOUNDS AS CGMP PDE INHIBITORS Pfizer Limited (GB) 2004-01-02 EP disclosed
US-20020198223-A1 Pharmaceutically active compounds PFIZER INC. 2002-12-26 US disclosed
WO-2002074312-A1 PYRAZOLO`4,3-D.PYRIMIDINONE COMPOUNDS AS CGMP PDE INHIBITORS PFIZER LIMITED (GB) 2002-09-26 WO 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-20020198223-A1 Pharmaceutically active compounds PDE5A, PDE3A, PDE2A HDAC8 1707/4885HDAC1 484/4885HDAC6 1080/4885

“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.