SCHEMBL7833197

SCHEMBL7833197

CC(O)CCc1cc(Oc2ccc(Cl)cc2)n2nccc2n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.40
PDE10A Q9Y233 3/20 0.36
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CRHR1 P34998 6/20 0.32
KCNN3 Q9UGI6 2/20 0.32
PRKAB2 O43741 1/20 0.32
PRKAG1 P54619 1/20 0.32
PRKAA2 P54646 1/20 0.32
PRKAA1 Q13131 1/20 0.32
PRKAG3 Q9UGI9 1/20 0.32
PRKAG2 Q9UGJ0 1/20 0.32
PRKAB1 Q9Y478 1/20 0.32
GAA P10253 1/20 0.32
NPBWR1 P48145 1/20 0.31
MCHR1 Q99705 1/20 0.31
CDK2 P24941 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
SCHEMBL7833160 0.90 PDE10A (0.41) LOXL2PDE10ACRHR1PRKAB2PRKAG1
SCHEMBL7831627 0.88 LOXL2 (0.50) LOXL2PDE10AKCNN3PRKAB2PRKAG1
SCHEMBL7829453 0.88 LOXL2 (0.46) LOXL2PDE10AMEN1KMT2AKCNN3
SCHEMBL7832891 0.86 POLB (0.35) LOXL2PDE10AALDH1A1MAPTPOLB
SCHEMBL7821319 0.85 LOXL2 (0.40) LOXL2PDE10AALDH1A1MAPTMEN1
SCHEMBL7832013 0.84 KDM5A (0.39) PDE10AMAPTPRKAB2PRKAG1PRKAA2
SCHEMBL7829236 0.83 LOXL2 (0.40) LOXL2PDE10AMEN1KMT2ACRHR1
SCHEMBL7835386 0.82 LOXL2 (0.39) LOXL2PDE10AALDH1A1KMT2ANPSR1
SCHEMBL7821057 0.81 LOXL2 (0.37) LOXL2PDE10APRKAB2PRKAG1PRKAA2
SCHEMBL7832213 0.81 LOXL2 (0.38) LOXL2PDE10ACRHR1KCNN3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0820997-B1 PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES OTSUKA PHARMA CO LTD (JP) 2001-07-25 EP disclosed
US-5985882-A ANALGESICS OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1999-11-16 US disclosed
EP-0820997-A1 PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1998-01-28 EP disclosed