SCHEMBL7002165

SCHEMBL7002165

COC(=O)c1nn(CC2CCC2)c(C(=O)O)c1[N+](=O)[O-]

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
P2RY14 Q15391 3/20 0.36
ALDH1A1 P00352 2/20 0.34
PTGER4 P35408 1/20 0.34
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
HTT P42858 1/20 0.32
AR P10275 1/20 0.32
LCK P06239 1/20 0.32
RET P07949 1/20 0.32
SRC P12931 1/20 0.32
CNR1 P21554 1/20 0.31

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
SCHEMBL7002157 0.93 ALDH1A1 (0.35) P2RY14ALDH1A1PTGER4MEN1KMT2A
SCHEMBL331277 0.90 CNR2 (0.37) ALDH1A1MEN1KMT2ASMN1; SMN2CNR1
SCHEMBL332202 0.82 MEN1 (0.33) ALDH1A1MEN1KMT2ASMN1; SMN2POLB
SCHEMBL7002042 0.81 LMNA (0.39) P2RY14ALDH1A1PTGER4MEN1KMT2A
SCHEMBL331632 0.80 SMN1; SMN2 (0.36) ALDH1A1MEN1KMT2ASMN1; SMN2CNR1
SCHEMBL5414653 0.77 POLB (0.41) ALDH1A1MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL332743 0.77 MEN1 (0.41) ALDH1A1MEN1KMT2ASMN1; SMN2CNR1
SCHEMBL7002038 0.76 LMNA (0.40) P2RY14PTGER4SMN1; SMN2LMNALCK
SCHEMBL28762839 0.76 POLB (0.36) ALDH1A1MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL332155 0.76 POLB (0.36) ALDH1A1MEN1KMT2ASMN1; SMN2LMNA

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