SCHEMBL7960233

SCHEMBL7960233

Cc1ccc(C2(O)CCN(CCCNNC(=O)NN)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 5/20 0.54
DRD2 P14416 8/20 0.53
DRD4 P21917 1/20 0.47
DRD3 P35462 1/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ADRA1A P35348 2/20 0.45
ADRA1D P25100 1/20 0.45
ADRA1B P35368 1/20 0.45

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
SCHEMBL7949619 0.89 DRD2 (0.53) CCR1DRD2DRD3ADRA1A
SCHEMBL7960074 0.89 DRD2 (0.62) CCR1DRD2ADRA1A
SCHEMBL7957456 0.88 CCR1 (0.56) CCR1DRD2MEN1KMT2AADRA1A
SCHEMBL7963515 0.83 CCR1 (0.58) CCR1DRD2KMT2AADRA1AADRA1D
SCHEMBL7949042 0.82 CCR1 (0.52) CCR1DRD2
SCHEMBL7960236 0.81 DRD2 (0.63) CCR1DRD2DRD4DRD3ADRA1A
SCHEMBL7963903 0.81 DRD2 (0.50) CCR1DRD2DRD4
SCHEMBL7957164 0.81 DRD2 (0.56) CCR1DRD2
SCHEMBL7964042 0.79 DRD2 (0.46) CCR1DRD2DRD4DRD3
SCHEMBL8568579 0.79 OPRM1 (0.58) CCR1DRD2DRD4DRD3ADRA1D

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