SCHEMBL432876

SCHEMBL432876

Clc1ccc2nc(-c3cccnc3)nc(NCc3ccccc3)c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 14/20 1.00
MEN1 O00255 4/20 0.74
KMT2A Q03164 4/20 0.74
ALDH1A1 P00352 4/20 0.74
CYP1A2 P05177 4/20 0.74
CYP3A4 P08684 4/20 0.74
CYP2D6 P10635 4/20 0.74
CYP2C19 P33261 4/20 0.74
TSHR P16473 3/20 0.74
MAPK1 P28482 3/20 0.74
HSD17B10 Q99714 3/20 0.74
CLK4 Q9HAZ1 2/20 0.74
USP2 O75604 2/20 0.74
LMNA P02545 2/20 0.74
GBA1 P04062 1/20 0.74
TP53 P04637 1/20 0.74
PTGS1 P23219 1/20 0.74
TBXAS1 P24557 1/20 0.74
PTGS2 P35354 1/20 0.74
MAPT P10636 2/20 0.70

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
SCHEMBL7285873 0.87 PDE5A (0.78) PDE5AMEN1KMT2AALDH1A1CYP1A2
SCHEMBL7442498 0.87 PDE5A (0.77) PDE5AMEN1KMT2AALDH1A1CYP1A2
SCHEMBL16183924 0.87 PDE5A (0.77) PDE5AMEN1KMT2AALDH1A1CYP1A2
SCHEMBL7279378 0.87 MEN1 (0.84) PDE5AMEN1KMT2AALDH1A1CYP1A2
SCHEMBL7280438 0.86 PDE5A (0.76) PDE5AMEN1KMT2AALDH1A1CYP1A2
SCHEMBL7280074 0.86 PDE5A (1.00) PDE5AMEN1KMT2AALDH1A1CYP1A2
SCHEMBL7431815 0.86 PDE5A (0.76) PDE5AMEN1KMT2AALDH1A1CYP1A2
SCHEMBL7436493 0.86 PDE5A (0.76) PDE5AMEN1KMT2AALDH1A1CYP1A2
SCHEMBL7281010 0.86 PDE5A (1.00) PDE5AMEN1KMT2AALDH1A1CYP1A2
SCHEMBL7286130 0.86 PDE5A (1.00) PDE5AMEN1KMT2AALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090041675-A1 Organic compounds TRIFILIEFF ALEXANDRE 2009-02-12 US claimed
WO-2009013286-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-01-29 WO claimed
EP-1890699-A1 INDACTEROL DERIVATIVES AND PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF AIRWAY DISEASES Novartis AG (CH) 2008-02-27 EP claimed
US-20070197560-A1 cGMP PDE 5 inhibitors for inhalation in the treatment of sexual dysfunction NAEF RETO 2007-08-23 US claimed
WO-2006128675-A1 INDACTEROL DERIVATIVES AND PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF AIRWAY DISEASES NOVARTIS AG (CH) 2006-12-07 WO claimed
EP-1140044-B1 cGMP PDE 5 INHIBITORS FOR INHALATION IN THE TREATMENT OF SEXUAL DYSFUNCTION NOVARTIS AG (CH) 2006-03-15 EP claimed
US-20040214831-A1 cGMP PDE 5 inhibitors for inhalation in the treatment of sexual dysfunction NAEF RETO 2004-10-28 US claimed
JP-2002532542-A 2002-10-02 JP claimed
US-20010055570-A1 Cyclic guanosine 3',5'-monophosphate phosphodiesterases (cGMP PDEs); using specified pyrazolopyrimidinone or aminoquinazoline derivatives NAEF RETO (CH) 2001-12-27 US claimed
EP-0579496-B1 4-Aminoquinazoline derivatives, and their use as medicine ONO PHARMACEUTICAL CO (JP) 2001-11-14 EP claimed
EP-1140044-A2 cGMP PDE 5 INHIBITORS FOR INHALATION IN THE TREATMENT OF SEXUAL DYSFUNCTION Novartis AG (CH) 2001-10-10 EP claimed
WO-2000037061-A2 cGMP PDE 5 INHIBITORS FOR INHALATION IN THE TREATMENT OF SEXUAL DYSFUNCTION NOVARTIS AG (CH) 2000-06-29 WO claimed
EP-0579496-A1 4-Aminoquinazoline derivatives, and their use as medicine ONO PHARMACEUTICAL CO., LTD. (JP) 1994-01-19 EP claimed
US-10994082-B2 Inhaler counter ASTRAZENECA AB (SE) 2021-05-04 US disclosed
US-20190175849-A1 INHALER COUNTER BANG & OLUFSEN MEDICOM A/S (DK) 2019-06-13 US disclosed
US-20180339119-A1 INHALER BANG & OLUFSEN MEDICOM A/S (DK) 2018-11-29 US disclosed
WO-2000037061-A2 cGMP PDE 5 INHIBITORS FOR INHALATION IN THE TREATMENT OF SEXUAL DYSFUNCTION NOVARTIS AG (CH) 2000-06-29 WO disclosed
US-5439895-A Cardiovascular disorders; inhibitor of thromboxane A2 synthetase and cyclic guanosine 3',5'-monophosphate ONO PHARMACEUTICAL CO., LTD. (JP) 1995-08-08 US disclosed
US-5436233-A Nervous system disorders ONO PHARMACEUTICAL CO., LTD. (JP) 1995-07-25 US disclosed
EP-0579496-A1 4-Aminoquinazoline derivatives, and their use as medicine ONO PHARMACEUTICAL CO., LTD. (JP) 1994-01-19 EP 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-20090041675-A1 Organic compounds PDE12, PDE5A, RXFP4 PDE5A 2/4885MEN1 4412/4885KMT2A 2668/4885

“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.