SCHEMBL7957372

SCHEMBL7957372

CCOC(=O)CCCN1CCC(c2ccc(F)c(Cl)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.51
DRD3 P35462 2/20 0.50
DRD4 P21917 1/20 0.50
MCHR1 Q99705 9/20 0.46
CCR2 P41597 1/20 0.45
NPY1R P25929 1/20 0.45
ADRA1A P35348 1/20 0.44
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HTR1A P08908 1/20 0.43
DRD1 P21728 1/20 0.43
DRD5 P21918 1/20 0.43
HTR2A P28223 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL7949175 0.92 DRD2 (0.48) DRD2DRD3DRD4MCHR1CCR2
SCHEMBL7949172 0.87 DRD2 (0.61) DRD2DRD3DRD4MCHR1HTR1A
SCHEMBL7963919 0.85 HSD17B10 (0.53) DRD2DRD3DRD4MCHR1NPY1R
SCHEMBL7949328 0.85 DRD2 (0.46) DRD2DRD3DRD4MCHR1CCR2
SCHEMBL7957636 0.83 NPY1R (0.47) DRD2DRD3DRD4MCHR1NPY1R
SCHEMBL7957439 0.82 DRD2 (0.55) DRD2DRD3DRD4MCHR1ADRA1A
SCHEMBL7964065 0.81 DRD2 (0.53) DRD2DRD3DRD4MCHR1CCR2
SCHEMBL7959172 0.81 DRD2 (0.62) DRD2DRD3DRD4NPY1R
SCHEMBL7959549 0.80 DRD2 (0.47) DRD2DRD3DRD4MCHR1SMN1; SMN2
SCHEMBL10595036 0.79 SLC18A3 (0.61) DRD2ADRA1ATSHRHTR1AHTR2A

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