SCHEMBL8720151

SCHEMBL8720151

COc1ccccc1CC(C)C(N)C(O)c1cccc(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 10/20 0.44
ADRB1 P08588 7/20 0.44
ADRB2 P07550 5/20 0.44
AOC3 Q16853 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PNMT P11086 1/20 0.38

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
SCHEMBL8720148 1.00 ADRB3 (0.44) ADRB3ADRB1ADRB2AOC3MEN1
SCHEMBL8717142 0.87 AOC3 (0.39) AOC3MEN1KMT2A
SCHEMBL8717141 0.87 AOC3 (0.39) AOC3MEN1KMT2A
SCHEMBL8717462 0.86 KMT2A (0.41) MEN1KMT2A
SCHEMBL8717465 0.86 KMT2A (0.41) MEN1KMT2A
SCHEMBL8720035 0.86 ATM (0.46) MEN1KMT2A
SCHEMBL8720039 0.86 ATM (0.46) MEN1KMT2A
SCHEMBL8714400 0.86 SLC6A4 (0.49)
SCHEMBL8714398 0.86 SLC6A4 (0.49)
SCHEMBL8714445 0.85 ADRB3 (0.49) ADRB3

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-5811293-A CULTURE PRODUCT AS CHEMICAL INTERMEDIATE FOR ANTI-OBESITY AGENT DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1998-09-22 US disclosed