SCHEMBL14958646

SCHEMBL14958646

COC(=O)C(CC(C)C)NC(=O)OCCCOC(=O)NC(CC(C)C)C(=O)OCCCCCCOC(=O)C(CC(C)C)NC(=O)OCCCOC(C)=O

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.42
TAS1R3 Q7RTX0 7/20 0.42
TAS1R1 Q7RTX1 7/20 0.42
BIRC2 Q13490 3/20 0.40
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL15180217 0.90 EPHX1 (0.37) FOLH1TAS1R3TAS1R1
SCHEMBL13991900 0.87 ACHE (0.35) FOLH1TAS1R3TAS1R1
SCHEMBL30174611 0.82 BIRC2 (0.54) FOLH1TAS1R3TAS1R1BIRC2
SCHEMBL7279383 0.80 FOLH1 (0.47) FOLH1TAS1R3TAS1R1BIRC2POLB
SCHEMBL7279380 0.80 FOLH1 (0.47) FOLH1TAS1R3TAS1R1BIRC2POLB
SCHEMBL11434953 0.76 TAS1R3 (0.54) FOLH1TAS1R3TAS1R1BIRC2POLB
SCHEMBL7751184 0.76 TAS1R3 (0.54) FOLH1TAS1R3TAS1R1BIRC2POLB
SCHEMBL13960047 0.75 ALDH1A1 (0.50) FOLH1TAS1R3TAS1R1BIRC2POLB
SCHEMBL14373742 0.75 ALDH1A1 (0.50) BIRC2
SCHEMBL11675841 0.75 ALDH1A1 (0.50) BIRC2

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-8445007-B2 Bis-(α-amino)-diol-diester-containing poly (ester amide) and poly (ester urethane) compositions and methods of use MEDIVAS, LLC (US) 2013-05-21 US disclosed