SCHEMBL7957641

SCHEMBL7957641

CCOC(=O)CCCN1CC=C(c2cc(C(F)(F)F)ccc2Cl)CC1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.44
PPARG P37231 9/20 0.44
PPARA Q07869 9/20 0.44
SUV39H2 Q9H5I1 2/20 0.43
DRD2 P14416 1/20 0.41
MGLL Q99685 1/20 0.40
SIGMAR1 Q99720 2/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
L3MBTL1 Q9Y468 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 0.83 PPARG (0.53) PPARGPPARASUV39H2DRD2SIGMAR1
SCHEMBL7963688 0.83 DRD2 (0.47) PPARGPPARASUV39H2DRD2SIGMAR1
SCHEMBL7963831 0.83 DRD2 (0.42) PPARGPPARADRD2SIGMAR1ALDH1A1
SCHEMBL2928576 0.81 HTR6 (0.44) PPARGPPARADRD2SIGMAR1
SCHEMBL7949222 0.80 DRD2 (0.49) PPARGPPARASUV39H2DRD2SIGMAR1
SCHEMBL7961255 0.80 DRD2 (0.52) PPARGPPARASUV39H2DRD2SIGMAR1
SCHEMBL7960280 0.79 DRD2 (0.46) PPARGPPARASUV39H2DRD2SIGMAR1
SCHEMBL7959566 0.79 PPARG (0.54) PPARGPPARASUV39H2DRD2SIGMAR1
SCHEMBL7964138 0.78 DRD2 (0.54) PPARGPPARASUV39H2DRD2SIGMAR1
SCHEMBL7957644 0.78 DRD2 (0.61) PPARGPPARADRD2SIGMAR1

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