SCHEMBL7949532

SCHEMBL7949532

NNC(=O)CCCN1CCC(O)(c2cccc(Cl)c2Cl)CC1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 15/20 0.66
DRD4 P21917 1/20 0.46
DRD3 P35462 1/20 0.46
CCR1 P32246 2/20 0.45
ADRA1A P35348 1/20 0.44
KMT2A Q03164 1/20 0.43
CACNA1G O43497 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
SCHEMBL7961381 0.91 DRD2 (0.64) DRD2DRD4DRD3CCR1ADRA1A
SCHEMBL7949530 0.83 DRD2 (0.56) DRD2DRD4DRD3CCR1ADRA1A
SCHEMBL7959857 0.82 DRD2 (0.46) DRD2DRD4DRD3CCR1KMT2A
SCHEMBL7957165 0.80 DRD2 (0.66) DRD2CCR1ADRA1A
SCHEMBL3856163 0.79 DRD2 (0.61) DRD2DRD4DRD3CCR1
SCHEMBL3856503 0.79 DRD2 (0.65) DRD2DRD4DRD3CCR1
SCHEMBL7960076 0.79 DRD2 (0.70) DRD2DRD4DRD3ADRA1AKMT2A
SCHEMBL7964044 0.79 DRD2 (0.53) DRD2DRD4DRD3ADRA1A
SCHEMBL7949576 0.78 DRD2 (0.48) DRD2DRD4DRD3KMT2ACACNA1G
SCHEMBL7961473 0.78 DRD2 (0.58) DRD2DRD4DRD3ADRA1AKMT2A

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