SCHEMBL8878650

SCHEMBL8878650

O=C(NCCCN1CCC(c2c[nH]c3cccc(Cl)c23)CC1)c1nccc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CCR2 P41597 19/20 0.54
▸ DRD2 P14416 1/20 0.46
▸ DRD3 P35462 1/20 0.46

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
SCHEMBL8876714 0.91 CCR2 (0.50) CCR2DRD2DRD3
SCHEMBL8877197 0.88 CCR2 (0.49) CCR2DRD2DRD3
SCHEMBL8877934 0.88 CCR2 (0.49) CCR2DRD2DRD3
SCHEMBL8878708 0.88 DRD2 (0.49) CCR2DRD2DRD3
SCHEMBL8877686 0.86 CCR2 (0.56) CCR2DRD2DRD3
SCHEMBL8877860 0.86 DRD2 (0.57) CCR2DRD2DRD3
SCHEMBL8878088 0.86 CCR2 (0.56) CCR2DRD2DRD3
SCHEMBL8877298 0.82 ADRA1D (0.54) CCR2DRD2DRD3
SCHEMBL9035452 0.81 CCR2 (0.54) CCR2DRD2DRD3
SCHEMBL8879246 0.81 CCR2 (0.54) CCR2DRD2DRD3

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-5670511-A Indolepiperidine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1997-09-23 — — US disclosed
EP-0722942-A1 Indole piperidine derivatives MERCK PATENT GmbH (DE) 1996-07-24 — — EP disclosed
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