SCHEMBL15745786

SCHEMBL15745786

CNC(CC(C)C)C(=O)CC(=O)C(CC(C)C)NC(=O)CC(=O)NC(CC(C)C)C(=O)OCOC(=O)C(CC(C)C)NC(=O)CC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 4/20 0.35
TAS1R1 Q7RTX1 4/20 0.35
ALDH1A1 P00352 1/20 0.34
BIRC2 Q13490 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MME P08473 1/20 0.32
TYR P14679 1/20 0.32
POLB P06746 1/20 0.31
REN P00797 1/20 0.31

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
SCHEMBL15745790 0.92 TAS1R3 (0.38) TAS1R3TAS1R1ALDH1A1BIRC2L3MBTL1
SCHEMBL15746387 0.90 ALDH1A1 (0.39) TAS1R3TAS1R1ALDH1A1BIRC2L3MBTL1
SCHEMBL15745785 0.85 TAS1R3 (0.34) TAS1R3TAS1R1ALDH1A1BIRC2L3MBTL1
SCHEMBL15746392 0.84 TAS1R3 (0.48) TAS1R3TAS1R1BIRC2MMEPOLB
SCHEMBL15745781 0.83 TAS1R3 (0.36) TAS1R3TAS1R1ALDH1A1BIRC2L3MBTL1
SCHEMBL15746403 0.83 TAS1R3 (0.40) TAS1R3TAS1R1ALDH1A1BIRC2L3MBTL1
SCHEMBL15745789 0.82 TAS1R3 (0.35) TAS1R3TAS1R1ALDH1A1BIRC2L3MBTL1
SCHEMBL14902193 0.76 L3MBTL1 (0.50) TAS1R3TAS1R1ALDH1A1BIRC2L3MBTL1
SCHEMBL14902192 0.76 TAS1R3 (0.54) TAS1R3TAS1R1BIRC2MMEPOLB
SCHEMBL27827937 0.76 TAS1R3 (0.54) TAS1R3TAS1R1BIRC2MMEPOLB

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-20140147686-A1 BIOLOGICALLY ABSORBABLE COATING FOR IMPLANTABLE DEVICES BASED ON COPOLYMERS HAVING ESTER BONDS AND METHODS OF FABRICATING THE SAME ABBOTT CARDIOVASCULAR SYSTEMS INC. (US) 2014-05-29 US disclosed