SCHEMBL6338375

SCHEMBL6338375

CCCOc1ccccc1-c1nc2c(CC)n(Cc3ccccn3)nc2c(=O)[nH]1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 20/20 0.68
PDE6C P51160 3/20 0.57
KDM4E B2RXH2 1/20 0.52
MEN1 O00255 1/20 0.52
PDE2A O00408 1/20 0.52
PDE6D O43924 1/20 0.52
USP2 O75604 1/20 0.52
PDE9A O76083 1/20 0.52
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
CYP1A2 P05177 1/20 0.52
MAPT P10636 1/20 0.52
HPGD P15428 1/20 0.52
ALOX15 P16050 1/20 0.52
PDE6A P16499 1/20 0.52
PDE6G P18545 1/20 0.52
PDE4A P27815 1/20 0.52
PDE6B P35913 1/20 0.52
PDE1A P54750 1/20 0.52
PDE1B Q01064 1/20 0.52

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
SCHEMBL6331957 0.94 PDE5A (0.64) PDE5APDE6CKDM4EMEN1PDE2A
SCHEMBL6332694 0.93 PDE5A (0.62) PDE5APDE6CKDM4EMEN1PDE2A
SCHEMBL7247988 0.93 PDE5A (0.59) PDE5APDE6CKDM4EMEN1ALDH1A1
SCHEMBL6334010 0.90 PDE5A (0.57) PDE5APDE6CKDM4EMEN1PDE2A
SCHEMBL6336873 0.90 PDE5A (0.57) PDE5APDE6CKDM4EMEN1PDE2A
SCHEMBL7001931 0.87 PDE5A (0.54) PDE5APDE6CKDM4EMEN1PDE2A
SCHEMBL6334213 0.87 PDE5A (0.63) PDE5APDE6CKDM4EMEN1ALDH1A1
SCHEMBL6775263 0.85 PDE5A (0.63) PDE5APDE6CKDM4EMEN1PDE2A
SCHEMBL7237581 0.85 PDE5A (0.74) PDE5APDE6CALDH1A1MAPT
SCHEMBL6332294 0.84 PDE5A (0.52) PDE5APDE6CKDM4EMEN1PDE2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6916927-B2 Pyrazolopyrimidinones which inhibit type 5 cyclic guanosine 3′,5′-monophosphate phosphodiesterase (cGMP-PDE5) for the treatment of sexual dysfunction PFIZER INC. 2005-07-12 US disclosed
US-20040180944-A1 Pyrazolopyrimidinones which inhibit type 5 cyclic guanosine 3',5'-monophosphate phosphodiesterase (cGMP-PDE5) for the treatment of sexual dysfunction PFIZER INC 2004-09-16 US disclosed
US-6723719-B1 DYSMENORRHOEA, BENIGN PROSTATIC HYPERPLASIA (BPH), BLADDER OUTLET OBSTRUCTION, INCONTINENCE, AGINA, CONGESTIVE HEART FAILURE, ATHEROSCLEROSIS; HYPOTENSIVE AND ANTIALLERGEN AGENTS PFIZER INC 2004-04-20 US disclosed
EP-0995750-A1 Pyrazolopyrimidinone cGMP PDE5 inhibitors for the treatment of sexual dysfunction PFIZER INC. (US) 2000-04-26 EP disclosed
EP-0977756-A1 PYRAZOLOPYRIMIDINONES WHICH INHIBIT TYPE 5 CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASE (cGMP PDE5) FOR THE TREATMENT OF SEXUAL DYSFUNCTION Pfizer Limited (GB) 2000-02-09 EP disclosed
WO-1998049166-A1 PYRAZOLOPYRIMIDINONES WHICH INHIBIT TYPE 5 CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASE (cGMP PDE5) FOR THE TREATMENT OF SEXUAL DYSFUNCTION PFIZER LIMITED (GB) 1998-11-05 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-20040180944-A1 Pyrazolopyrimidinones which inhibit type 5 cyclic guanosine 3',5'-monophosphate phosphodiesterase (cGMP-PDE5) for the treatment of sexual dysfunction PDE5A, PDE3A, PDE3B PDE5A 1/4885PDE6C 26/4885KDM4E 996/4885

“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.