Behenic Acid

Behenic Acid

SCHEMBL3344680

CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].NCCO.[K+]

nearest known ligand 0.76

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

MPL

The experimentally established mechanism targets of Behenic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 7/20 0.61
CA1 P00915 1/20 0.56
CES2 O00748 4/20 0.52
CES1 P23141 4/20 0.52
NFKB1 P19838 1/20 0.47

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
Oleic Acid SCHEMBL3241166 0.90 FABP3 (0.81) FABP3
Valeric Acid SCHEMBL7559897 0.88 CA1 (0.67) FABP3CA1CES2CES1NFKB1
Decanoic Acid SCHEMBL11579248 0.88 FABP3 (0.62) FABP3CA1CES2CES1NFKB1
Octanoic Acid SCHEMBL11457952 0.88 FABP3 (0.62) FABP3CA1CES2CES1NFKB1
Myristic Acid SCHEMBL14166460 0.87 FABP3 (0.76) FABP3CA1CES2CES1
Heptanoate SCHEMBL107720 0.87 FABP3 (0.76) FABP3CA1CES2CES1
Heptanoate SCHEMBL17092949 0.87 FABP3 (0.72) FABP3CA1CES2CES1NFKB1
Decanoic Acid SCHEMBL107025 0.87 FABP3 (0.76) FABP3CA1CES2CES1
Palmitic Acid SCHEMBL1332572 0.87 FABP3 (0.76) FABP3CA1CES2CES1
Dodecanoate SCHEMBL9187682 0.87 FABP3 (0.72) FABP3CA1CES2CES1NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8252730-B2 Wellbore treatment fluid SCHLUMBERGER TECHNOLOGY CORPORATION (US) 2012-08-28 US disclosed
US-20100152068-A1 WELLBORE TREATMENT FLUID SCHLUMBERGER TECHNOLOGY CORPORATION (US) 2010-06-17 US disclosed
WO-2008102122-A1 WELLBORE TREATMENT FLUID SCHLUMBERGER TECHNOLOGY B.V. (NL) 2008-08-28 WO disclosed