SCHEMBL8004295

SCHEMBL8004295

COc1ccc(C2=C(c3ccc(OCCN(C(C)C)C(C)C)cc3)c3ccccc3CC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 12/20 0.55
ESR2 Q92731 8/20 0.55
EBP Q15125 1/20 0.53
SIGMAR1 Q99720 1/20 0.53
MCHR1 Q99705 3/20 0.52
LTA4H P09960 1/20 0.45
ACHE P22303 1/20 0.43

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
SCHEMBL8004280 0.88 ESR1 (0.70) ESR1ESR2EBPSIGMAR1LTA4H
SCHEMBL8004293 0.85 LTA4H (0.53) ESR1ESR2EBPSIGMAR1MCHR1
SCHEMBL4651133 0.83 MCHR1 (0.58) ESR1ESR2MCHR1LTA4H
SCHEMBL17152127 0.81 ESR1 (0.69) ESR1ESR2EBPSIGMAR1LTA4H
SCHEMBL8003921 0.77 EBP (0.78) ESR1ESR2EBPSIGMAR1MCHR1
SCHEMBL6756238 0.74 ESR1 (0.80) ESR1ESR2EBPSIGMAR1
SCHEMBL13109358 0.74 EBP (0.74) ESR1ESR2EBPSIGMAR1
SCHEMBL8004275 0.73 ESR1 (0.54) ESR1ESR2LTA4H
SCHEMBL6756233 0.72 ESR1 (0.68) ESR1ESR2EBPSIGMAR1LTA4H
SCHEMBL11188218 0.72 MCHR1 (0.46) ESR1ESR2MCHR1ACHE

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-6114336-A Cosmetic composition containing a neuropeptide Y receptor antagonist SANOFI (FR) 2000-09-05 US disclosed