SCHEMBL7959566

SCHEMBL7959566

CCOC(=O)CCCN1CC=C(c2cccc(Cl)c2Cl)CC1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.54
PPARA Q07869 4/20 0.54
SUV39H2 Q9H5I1 2/20 0.44
SIGMAR1 Q99720 3/20 0.43
DRD2 P14416 3/20 0.41
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
HTR1A P08908 2/20 0.40
LMNA P02545 1/20 0.39

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
SCHEMBL7959540 0.92 PPARG (0.53) PPARGPPARASUV39H2SIGMAR1DRD2
SCHEMBL7957405 0.83 TNF (0.50) DRD2
SCHEMBL7957644 0.81 DRD2 (0.61) PPARGPPARASIGMAR1DRD2HTR1A
SCHEMBL7960280 0.81 DRD2 (0.46) PPARGPPARASUV39H2SIGMAR1DRD2
SCHEMBL8570913 0.81 PPARG (0.54) PPARGPPARASUV39H2SIGMAR1DRD2
SCHEMBL7949197 0.81 PPARG (0.47) PPARGPPARASIGMAR1DRD2KDM4E
SCHEMBL7961282 0.80 SIGMAR1 (0.52) PPARGPPARASUV39H2SIGMAR1DRD2
SCHEMBL7949222 0.80 DRD2 (0.49) PPARGPPARASUV39H2SIGMAR1DRD2
SCHEMBL3766147 0.79 PPARG (0.52) PPARGPPARASIGMAR1DRD2HTR1A
SCHEMBL7957641 0.79 TRPV1 (0.44) PPARGPPARASUV39H2SIGMAR1DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6187774-B1 N-PIPERAZINYLALKYLINDAZOLE DERIVATIVES; PSYCHOLOGICAL DISORDERS, SCHIZOPHRENIA; SIDE EFFECT REDUCTION YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2001-02-13 US disclosed
EP-0885883-A1 FUSED HETEROCYCLIC COMPOUNDS AND PHARMACEUTICAL APPLICATIONS THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1998-12-23 EP disclosed