SCHEMBL7533764

SCHEMBL7533764

CCC(NC(=O)Nc1ccc(C[C@@H](CO)NC[C@@H](COc2ccccc2)OC(=O)C(F)(F)F)cc1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 12/20 0.58
ADRB1 P08588 10/20 0.58
FPR2 P25090 7/20 0.45

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
Trifluoroacetic Acid SCHEMBL7533778 0.88 ADRB3 (0.73) ADRB3ADRB1FPR2
SCHEMBL6539718 0.87 ADRB3 (0.61) ADRB3ADRB1
SCHEMBL6539506 0.86 ADRB3 (0.59) ADRB3ADRB1
SCHEMBL6539488 0.85 ADRB3 (0.57) ADRB3ADRB1
SCHEMBL7532289 0.85 ADRB3 (0.58) ADRB3ADRB1
SCHEMBL6541344 0.85 ADRB3 (0.58) ADRB3ADRB1
SCHEMBL6539964 0.84 ADRB3 (0.57) ADRB3ADRB1
SCHEMBL6539720 0.84 ADRB3 (0.60) ADRB3ADRB1
SCHEMBL6539092 0.83 ADRB3 (0.62) ADRB3ADRB1
SCHEMBL6539734 0.83 ADRB3 (0.62) ADRB3ADRB1

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
WO-2002024635-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-03-28 WO disclosed