SCHEMBL29929086

SCHEMBL29929086

CCCCCCCCCCCCC[C@H](O)CC(=O)CCc1ccc(O)c(OC)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 6/20 1.00
CYP3A4 P08684 5/20 1.00
CYP2C8 P10632 4/20 1.00
CYP2C9 P11712 4/20 1.00
CYP2B6 P20813 4/20 1.00
CYP2C19 P33261 4/20 1.00
HTR1A P08908 3/20 1.00
CYP1A2 P05177 3/20 1.00
CYP2D6 P10635 2/20 1.00
CYP2A6 P11509 2/20 1.00
CYP2E1 P05181 1/20 1.00
TRPV1 Q8NER1 5/20 0.98
POLB P06746 1/20 0.71
GAA P10253 1/20 0.71

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
SCHEMBL29801691 1.00 LTA4H (1.00) LTA4HCYP3A4CYP2C8CYP2C9CYP2B6
SCHEMBL29929555 1.00 LTA4H (1.00) LTA4HCYP3A4CYP2C8CYP2C9CYP2B6
SCHEMBL4883453 1.00 LTA4H (1.00) LTA4HCYP3A4CYP2C8CYP2C9CYP2B6
SCHEMBL4885722 1.00 LTA4H (1.00) LTA4HCYP3A4CYP2C8CYP2C9CYP2B6
SCHEMBL17301612 1.00 LTA4H (1.00) LTA4HCYP3A4CYP2C8CYP2C9CYP2B6
SCHEMBL29928887 1.00 LTA4H (1.00) LTA4HCYP3A4CYP2C8CYP2C9CYP2B6
SCHEMBL17301613 1.00 LTA4H (1.00) LTA4HCYP3A4CYP2C8CYP2C9CYP2B6
SCHEMBL20668179 1.00 LTA4H (1.00) LTA4HCYP3A4CYP2C8CYP2C9CYP2B6
SCHEMBL20668234 1.00 LTA4H (1.00) LTA4HCYP3A4CYP2C8CYP2C9CYP2B6
SCHEMBL29929493 1.00 LTA4H (1.00) LTA4HCYP3A4CYP2C8CYP2C9CYP2B6

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240315965-A1 COMPOSITIONS AND METHODS RELATED TO PHARMACEUTICAL EXCIPIENTS Natural Extraction Systems, LLC (US) 2024-09-26 US claimed
WO-2022182527-A1 COMPOSITIONS AND METHODS RELATED TO PHARMACEUTICAL EXCIPIENTS Natural Extraction Systems, LLC (US) 2022-09-01 WO claimed
US-20240315965-A1 COMPOSITIONS AND METHODS RELATED TO PHARMACEUTICAL EXCIPIENTS Natural Extraction Systems, LLC (US) 2024-09-26 US disclosed
WO-2022182527-A1 COMPOSITIONS AND METHODS RELATED TO PHARMACEUTICAL EXCIPIENTS Natural Extraction Systems, LLC (US) 2022-09-01 WO disclosed