SCHEMBL6999112

SCHEMBL6999112

COC(=O)c1nn(C)c(C(=O)O)c1[N+](=O)[O-]

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
PKM P14618 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
MAPT P10636 3/20 0.40
CYP1A2 P05177 2/20 0.38
POLB P06746 1/20 0.38
BLM P54132 1/20 0.38
GAA P10253 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
F2 P00734 1/20 0.36
PLAU P00749 1/20 0.36
KLKB1 P03952 1/20 0.36
ELANE P08246 1/20 0.36
CTRB1 P17538 1/20 0.36

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
Hydrochloric Acid SCHEMBL7001018 0.98 MEN1 (0.50) MEN1KMT2APKMSMN1; SMN2MAPT
SCHEMBL7005474 0.90 MEN1 (0.53) MEN1KMT2APKMSMN1; SMN2MAPT
SCHEMBL7003999 0.89 MEN1 (0.50) MEN1KMT2APKMSMN1; SMN2MAPT
SCHEMBL4705798 0.87 MEN1 (0.46) MEN1KMT2APKMSMN1; SMN2MAPT
SCHEMBL7001014 0.86 MEN1 (0.50) MEN1KMT2APKMSMN1; SMN2MAPT
SCHEMBL6997732 0.86 SMN1; SMN2 (0.56) MEN1KMT2APKMSMN1; SMN2MAPT
SCHEMBL6994179 0.82 MEN1 (0.49) MEN1KMT2APKMSMN1; SMN2MAPT
SCHEMBL332743 0.80 MEN1 (0.41) MEN1KMT2ASMN1; SMN2MAPTF2
SCHEMBL333010 0.79 MEN1 (0.38) MEN1KMT2APKMSMN1; SMN2MAPT
SCHEMBL1609142 0.77 MAPT (0.61) MEN1KMT2APKMMAPTCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1123296-B1 PYRAZOLOPYRIMIDINONE cGMP PDE5 INHIBITORS FOR THE TREATMENT OF SEXUAL DYSFUNCTION PFIZER LTD (GB) 2003-09-17 EP disclosed
US-6333330-B1 Pyrazolopyrimidinone CGMP PDE5 inhibitors for the treatment of sexual dysfunction PFIZER INC. 2001-12-25 US disclosed
EP-1123296-A1 PYRAZOLOPYRIMIDINONE cGMP PDE5 INHIBITORS FOR THE TREATMENT OF SEXUAL DYSFUNCTION Pfizer Limited (GB) 2001-08-16 EP disclosed
WO-2000024745-A1 PYRAZOLOPYRIMIDINONE cGMP PDE5 INHIBITORS FOR THE TREATMENT OF SEXUAL DYSFUNCTION PFIZER LIMITED (GB) 2000-05-04 WO disclosed