SCHEMBL7961179

SCHEMBL7961179

NNC(=O)CCCN1CCC(c2ccc(Cl)cc2F)CC1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.47
CACNA1G O43497 9/20 0.46
OPRL1 P41146 2/20 0.45
DRD4 P21917 1/20 0.42
DRD3 P35462 1/20 0.42
ALDH1A1 P00352 2/20 0.42
CCR2 P41597 1/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL7957634 0.87 ALDH1A1 (0.50) DRD2CACNA1GDRD4DRD3ALDH1A1
SCHEMBL7961177 0.83 OPRL1 (0.44) DRD2OPRL1CCR2
SCHEMBL7964065 0.82 DRD2 (0.53) DRD2DRD4DRD3CCR2
SCHEMBL7949583 0.82 DRD2 (0.54) DRD2CACNA1GDRD4DRD3ALDH1A1
SCHEMBL7960163 0.81 DRD2 (0.62) DRD2DRD4DRD3CCR2
SCHEMBL7957636 0.81 NPY1R (0.47) DRD2OPRL1DRD4DRD3ALDH1A1
SCHEMBL7963815 0.80 DRD2 (0.50) DRD2DRD4DRD3CCR2
SCHEMBL7949576 0.80 DRD2 (0.48) DRD2CACNA1GDRD4DRD3ALDH1A1
SCHEMBL7957585 0.79 KMT2A (0.48) DRD2CACNA1GOPRL1CCR2POLB
SCHEMBL7959651 0.78 ALDH1A1 (0.43) DRD2DRD4DRD3ALDH1A1CCR2

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