SCHEMBL6291920

SCHEMBL6291920

COC(=CC=Cc1cc2cc(Cl)c(Cl)cc2[nH]1)C(=O)NCCCN1CCN(c2ccccc2OC)CC1

nearest known ligand 0.76

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ATP6V1B1 P15313 2/20 0.76
DRD2 P14416 8/20 0.51
DRD3 P35462 8/20 0.51
DRD4 P21917 4/20 0.51
HTR1A P08908 1/20 0.50
ADRA2A P08913 1/20 0.50
ADRA1D P25100 1/20 0.50
ADRA1A P35348 1/20 0.50
ADRA1B P35368 1/20 0.50

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
SCHEMBL6291918 1.00 ATP6V1B1 (0.76) ATP6V1B1DRD2DRD3DRD4HTR1A
SCHEMBL6291919 1.00 ATP6V1B1 (0.76) ATP6V1B1DRD2DRD3DRD4HTR1A
SCHEMBL6292791 0.95 ATP6V1B1 (0.68) ATP6V1B1DRD2DRD4HTR1AADRA2A
SCHEMBL6292794 0.95 ATP6V1B1 (0.68) ATP6V1B1DRD2DRD4HTR1AADRA2A
SCHEMBL6296252 0.94 ATP6V1B1 (0.80) ATP6V1B1DRD2DRD3DRD4ADRA1A
SCHEMBL6296250 0.94 ATP6V1B1 (0.80) ATP6V1B1DRD2DRD3DRD4ADRA1A
SCHEMBL6296254 0.94 ATP6V1B1 (0.80) ATP6V1B1DRD2DRD3DRD4ADRA1A
SCHEMBL6363567 0.89 ATP6V1B1 (0.80) ATP6V1B1DRD2DRD3DRD4
SCHEMBL6363568 0.89 ATP6V1B1 (0.80) ATP6V1B1DRD2DRD3DRD4
SCHEMBL6292751 0.87 ATP6V1B1 (0.76) ATP6V1B1DRD2DRD3DRD4HTR1A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6903117-B2 Indole derivatives for the treatment of osteoporosis NIKEM RESEARCH S.R.L. (IT) 2005-06-07 US disclosed