SCHEMBL7832017

SCHEMBL7832017

C=CCCc1cc(OCc2ccccc2)n2nccc2n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 6/20 0.39
SLC6A4 P31645 6/20 0.39
HTR2A P28223 3/20 0.39
KCNN3 Q9UGI6 2/20 0.37
KCNN1 Q92952 1/20 0.37
KCNN2 Q9H2S1 1/20 0.37
LOXL2 Q9Y4K0 1/20 0.36
KDM5A P29375 2/20 0.36
KDM4C Q9H3R0 2/20 0.36
KDM5B Q9UGL1 1/20 0.36
APOBEC3G Q9HC16 1/20 0.34
CCNE1 P24864 1/20 0.34
CDK2 P24941 1/20 0.34
MAPKAPK2 P49137 2/20 0.33
PRKAB2 O43741 1/20 0.33
PRKAG1 P54619 1/20 0.33
PRKAA2 P54646 1/20 0.33
PRKAA1 Q13131 1/20 0.33
PRKAG3 Q9UGI9 1/20 0.33
PRKAG2 Q9UGJ0 1/20 0.33

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
SCHEMBL7820793 0.91 CDK2 (0.34) LOXL2CDK2PRKAB2PRKAG1PRKAA2
SCHEMBL7832880 0.89 CDK2 (0.41) KDM4CCCNE1CDK2
SCHEMBL7821004 0.89 KDM5A (0.38) HTR2CSLC6A4HTR2AKCNN3KCNN1
SCHEMBL7830272 0.87 GABRA1 (0.39) LOXL2
SCHEMBL7821067 0.87 PRKAB2 (0.31) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL7832874 0.87 KDM5A (0.40) KDM5AKDM4CKDM5BPRKAB2PRKAG1
SCHEMBL7833635 0.83 LOXL2 (0.48) KCNN3KCNN1KCNN2LOXL2CCNE1
SCHEMBL7829229 0.81 LTA4H (0.39) HTR2CSLC6A4HTR2AKCNN3KCNN1
SCHEMBL7835469 0.81 HTR2C (0.38) HTR2CSLC6A4HTR2AKCNN3KCNN1
SCHEMBL7831750 0.80 PDE10A (0.37) CDK2PRKAB2PRKAG1PRKAA2PRKAA1

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