SCHEMBL1872915

SCHEMBL1872915

CCCOc1ccc(C(=O)CN2CCOCC2)cc1-c1nc2c(CCC)n[nH]c2c(=O)n1C

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 16/20 0.58
PDE6C P51160 3/20 0.58
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
PDE1A P54750 1/20 0.38
PDE1B Q01064 1/20 0.38
PDE1C Q14123 1/20 0.38
PDE11A Q9HCR9 1/20 0.38
KIT P10721 1/20 0.38
KDR P35968 1/20 0.38
FLT3 P36888 1/20 0.38
HRH3 Q9Y5N1 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
SCHEMBL5085819 0.95 PDE5A (0.65) PDE5APDE6CALDH1A1MAPTHSD17B10
SCHEMBL7167750 0.91 PDE5A (0.54) PDE5APDE6CALDH1A1MAPTHSD17B10
SCHEMBL6058528 0.87 PDE5A (0.67) PDE5APDE6CALDH1A1MAPTHSD17B10
SCHEMBL5990273 0.80 PDE5A (0.50) PDE5APDE6CALDH1A1MAPTHSD17B10
SCHEMBL29611957 0.79 PDE5A (0.90) PDE5APDE6C
SCHEMBL146830 0.79 PDE5A (0.90) PDE5APDE6C
SCHEMBL2437931 0.78 PDE4A (0.53) PDE5APDE6CALDH1A1MEN1KMT2A
SCHEMBL5964550 0.77 PDE5A (0.70) PDE5APDE6C
SCHEMBL7019550 0.77 PDE5A (0.46) PDE5APDE6CHSD17B10KMT2APDE1A
SCHEMBL7446947 0.76 ALDH1A1 (0.46) PDE5APDE6CALDH1A1MAPTHSD17B10

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 100 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1418896-A2 ADMINISTRATION OF PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF PREMATURE EJACULATION Vivus, Inc. (US) 2004-05-19 EP claimed
JP-2003525845-A 2003-09-02 JP claimed
WO-2003000343-A2 ADMINISTRATION OF PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF PREMATURE EJACULATION VIVUS, INC. (US) 2003-01-03 WO claimed
EP-1027054-A4 LOCAL ADMINISTRATION OF PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF ERECTILE DYSFUNCTION VIVUS INC (US) 2002-11-04 EP claimed
EP-1237577-A2 TRANSMUCOSAL COMPOSITION CONTAINING A PHOSPHODIESTERASE INHIBITOR FOR THE TREATMENT OF ERECTILE DYSFUNCTION Vivus, Inc. (US) 2002-09-11 EP claimed
WO-2001041807-A2 TRANSMUCOSAL COMPOSITION CONTAINING A PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF ERECTILE DYSFUNCTION VIVUS, INC. (US) 2001-06-14 WO claimed
EP-1027054-A1 LOCAL ADMINISTRATION OF PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF ERECTILE DYSFUNCTION Vivus, Inc. (US) 2000-08-16 EP claimed
WO-1999021558-A2 LOCAL ADMINISTRATION OF PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF ERECTILE DYSFUNCTION VIVUS, INC. (US) 1999-05-06 WO claimed
EP-2512479-A1 METHODS AND COMPOSITIONS FOR TREATING PERIPHERAL VASCULAR DISEASE Exodos Life Sciences Limited Partnership (US) 2012-10-24 EP disclosed
WO-2011075655-A1 METHODS AND COMPOSITIONS FOR TREATING PERIPHERAL VASCULAR DISEASE EXODOS LIFE SCIENCES LIMITED PARTNERSHIP (US) 2011-06-23 WO disclosed
US-20110107442-A1 Treatment of Male Sexual Dysfunction IXCHELSIS LIMITED (GB) 2011-05-05 US disclosed
EP-2222665-A1 AZETIDINES AS EP2 ANTAGONISTS Pfizer Limited (GB) 2010-09-01 EP disclosed
EP-2155666-A1 AZETIDINE DERIVATIVES AND THEIR USE AS PROSTAGLANDIN E2 ANTAGONISTS Pfizer Limited (GB) 2010-02-24 EP disclosed
US-7649003-B2 Substituted triazole derivatives as oxytocin antagonists PFIZER INC. (US) 2010-01-19 US disclosed
WO-2002013798-A2 TREATMENT OF THE INSULIN RESISTANCE SYNDROME WITH SELECTIVE CGMP PDE5 INHIBITORS PFIZER LIMITED (GB) 2002-02-21 WO disclosed
WO-2002003995-A2 TREATMENT OF MALE SEXUAL DYSFUNCTION PFIZER LIMITED (GB) 2002-01-17 WO disclosed
WO-2002002513-A1 CYCLOPENTYL-SUBSTITUTED GLUTARAMIDE DERIVATIVES AS INHIBITORS OF NEUTRAL ENDOPEPTIDASE PFIZER LIMITED (GB) 2002-01-10 WO disclosed
EP-1125582-A2 Use of estrogen agonists / antagonists for the treatment of sexual dysfunction Pfizer Products Inc. (US) 2001-08-22 EP disclosed
EP-1027054-A1 LOCAL ADMINISTRATION OF PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF ERECTILE DYSFUNCTION Vivus, Inc. (US) 2000-08-16 EP disclosed
WO-1999021558-A2 LOCAL ADMINISTRATION OF PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF ERECTILE DYSFUNCTION VIVUS, INC. (US) 1999-05-06 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-20110107442-A1 Treatment of Male Sexual Dysfunction OXTR, AVPR1B, AVPR2 PDE5A 73/4885PDE6C 961/4885ALDH1A1 3966/4885

“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.