SCHEMBL7957632

SCHEMBL7957632

Cc1cc(Cl)ccc1C1CCN(CCCNNC(=O)NN)CC1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 3/20 0.42
DRD2 P14416 3/20 0.42
DRD4 P21917 2/20 0.42
DRD3 P35462 2/20 0.42
MAPT P10636 2/20 0.41
PROKR1 Q8TCW9 1/20 0.41
CCR3 P51677 1/20 0.40
TP53 P04637 1/20 0.40
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL7961177 0.88 OPRL1 (0.44) CCR2DRD2
SCHEMBL7949578 0.83 DRD2 (0.46) CCR2DRD2DRD3
SCHEMBL7957634 0.83 ALDH1A1 (0.50) DRD2DRD4DRD3PROKR1POLB
SCHEMBL7960161 0.83 CCR2 (0.53) CCR2DRD2DRD4DRD3
SCHEMBL7949574 0.81 DRD2 (0.46) CCR2DRD2DRD4DRD3
SCHEMBL7957582 0.81 OPRL1 (0.45) CCR2DRD2DRD4DRD3CCR3
SCHEMBL7964042 0.79 DRD2 (0.46) DRD2DRD4DRD3
SCHEMBL7957650 0.78 ADRA1A (0.56) DRD2DRD4DRD3SMN1; SMN2
SCHEMBL7964064 0.78 CCR2 (0.48) CCR2DRD2DRD3
SCHEMBL7961256 0.78 CCR2 (0.39) CCR2DRD2CCR3

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