SCHEMBL6764196

SCHEMBL6764196

COCC1=C(C(=O)OC)[C@H](c2ccc(F)c(F)c2)N(C(=O)NCCCN2CCC(c3cccc(N)c3)CC2)C(=O)N1

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 18/20 0.81
MCHR1 Q99705 3/20 0.81
DRD2 P14416 1/20 0.81
ADRA1D P25100 16/20 0.71
ADRA1B P35368 16/20 0.71

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
SCHEMBL5661401 0.94 ADRA1A (0.73) ADRA1AMCHR1DRD2ADRA1DADRA1B
SCHEMBL7096127 0.94 ADRA1A (0.73) ADRA1AMCHR1DRD2ADRA1DADRA1B
Snap-7941 SCHEMBL5658585 0.90 ADRA1A (1.00) ADRA1AMCHR1DRD2ADRA1DADRA1B
SCHEMBL31060823 0.89 ADRA1A (0.88) ADRA1AMCHR1DRD2ADRA1DADRA1B
SCHEMBL6735535 0.85 ADRA1A (1.00) ADRA1AMCHR1DRD2ADRA1DADRA1B
SCHEMBL6735531 0.85 ADRA1A (1.00) ADRA1AMCHR1DRD2ADRA1DADRA1B
SCHEMBL3986844 0.84 ADRA1A (0.90) ADRA1AMCHR1DRD2ADRA1DADRA1B
SCHEMBL6764200 0.83 ADRA1A (0.60) ADRA1AMCHR1DRD2ADRA1DADRA1B
SCHEMBL6712292 0.83 ADRA1A (0.79) ADRA1AMCHR1DRD2ADRA1DADRA1B
SCHEMBL7093785 0.83 ADRA1A (0.79) ADRA1AMCHR1DRD2ADRA1DADRA1B

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-6727264-B1 MELANIN CONCENTRATING HORMONE-1 RECEPTOR ANTAGONISTS; SLEEP, EATING, SEXUAL DISORDERS SYNAPTIC PHARMACEUTICAL CORPORATION 2004-04-27 US disclosed