SCHEMBL5595244

SCHEMBL5595244

O=C(O)c1cccc(Nc2nc(Cc3ncc[nH]3)nc3ccc(Cl)cc23)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 11/20 0.47
CSNK2A2 P19784 8/20 0.47
CSNK2B P67870 8/20 0.47
PIM1 P11309 3/20 0.47
PIM2 Q9P1W9 3/20 0.47
KDM4E B2RXH2 1/20 0.45
CHEK1 O14757 1/20 0.44
GAK O14976 1/20 0.44
DAPK3 O43293 1/20 0.44
DYRK3 O43781 1/20 0.44
ULK1 O75385 1/20 0.44
STK10 O94804 1/20 0.44
CCNB2 O95067 1/20 0.44
CDK1 P06493 1/20 0.44
CCNB1 P14635 1/20 0.44
PHKG2 P15735 1/20 0.44
CCNE1 P24864 1/20 0.44
CDK2 P24941 1/20 0.44
TYK2 P29597 1/20 0.44
FLT3 P36888 1/20 0.44

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 SCHEMBL7277289 0.99 CSNK2A1 (0.46) CSNK2A1CSNK2A2CSNK2BPIM1PIM2
SCHEMBL5595291 0.87 EGFR (0.42) KDM4EABCG2MEN1KMT2A
Hydrochloric Acid SCHEMBL7289558 0.86 EGFR (0.41) KDM4EABCG2MEN1KMT2A
SCHEMBL5595236 0.76 CSNK2A1 (0.49) CSNK2A1CSNK2A2CSNK2BPIM1PIM2
SCHEMBL5595129 0.75 PDE5A (0.52) KDM4EPDE4DL3MBTL1
Hydrochloric Acid SCHEMBL7277276 0.75 CSNK2A1 (0.48) CSNK2A1CSNK2A2CSNK2BPIM1PIM2
Hydrochloric Acid SCHEMBL7278529 0.75 PDE5A (0.53) KDM4EPDE4DL3MBTL1
SCHEMBL20338809 0.73 CSNK2A1 (0.55) CSNK2A1CSNK2A2CSNK2BPIM1PIM2
SCHEMBL29786964 0.73 CSNK2A1 (0.55) CSNK2A1CSNK2A2CSNK2BPIM1PIM2
SCHEMBL23455427 0.69 AKR1C3 (0.59) CSNK2A2CSNK2BKDM4EGSK3BTOP2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0579496-B1 4-Aminoquinazoline derivatives, and their use as medicine ONO PHARMACEUTICAL CO (JP) 2001-11-14 EP claimed
US-5436233-A Nervous system disorders ONO PHARMACEUTICAL CO., LTD. (JP) 1995-07-25 US claimed
EP-0579496-A1 4-Aminoquinazoline derivatives, and their use as medicine ONO PHARMACEUTICAL CO., LTD. (JP) 1994-01-19 EP claimed
US-20070197560-A1 cGMP PDE 5 inhibitors for inhalation in the treatment of sexual dysfunction NAEF RETO 2007-08-23 US disclosed
US-20040214831-A1 cGMP PDE 5 inhibitors for inhalation in the treatment of sexual dysfunction NAEF RETO 2004-10-28 US disclosed
US-20010055570-A1 Cyclic guanosine 3',5'-monophosphate phosphodiesterases (cGMP PDEs); using specified pyrazolopyrimidinone or aminoquinazoline derivatives NAEF RETO (CH) 2001-12-27 US disclosed
EP-1140044-A2 cGMP PDE 5 INHIBITORS FOR INHALATION IN THE TREATMENT OF SEXUAL DYSFUNCTION Novartis AG (CH) 2001-10-10 EP disclosed
WO-2000037061-A2 cGMP PDE 5 INHIBITORS FOR INHALATION IN THE TREATMENT OF SEXUAL DYSFUNCTION NOVARTIS AG (CH) 2000-06-29 WO disclosed
WO-1999059584-A1 COMBINATION OF PHENTOLAMINE AND CYCLIC GMP PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF SEXUAL DYSFUNCTION SCHERING CORPORATION (US) 1999-11-25 WO disclosed