Dodecanoate

Dodecanoate

SCHEMBL5320074

CCCCCCCCCCCC(=O)[O-].C[N+](C)(C)CCO.C[N+](C)(C)CCO.[Cl-]

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3GNRHRMPLPDE3APDE3BPDE4APDE4BPDE4CPDE4DPPARASLC5A2

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

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 7/20 0.53
CA1 P00915 1/20 0.50
BBOX1 O75936 2/20 0.47
CES2 O00748 3/20 0.47
CES1 P23141 3/20 0.47
DNM1 Q05193 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
Myristic Acid SCHEMBL5317287 1.00 FABP3 (0.53) FABP3CA1BBOX1CES2CES1
Palmitic Acid SCHEMBL5319013 1.00 FABP3 (0.53) FABP3CA1BBOX1CES2CES1
Decanoic Acid SCHEMBL5318915 1.00 FABP3 (0.53) FABP3CA1BBOX1CES2CES1
Stearic Acid SCHEMBL3459527 1.00 FABP3 (0.53) FABP3CA1BBOX1CES2CES1
Decanoic Acid SCHEMBL580470 0.98 FABP3 (0.55) FABP3CA1BBOX1CES2CES1
Stearic Acid SCHEMBL840883 0.98 FABP3 (0.55) FABP3CA1BBOX1CES2CES1
Dodecanoate SCHEMBL19253062 0.98 FABP3 (0.55) FABP3CA1BBOX1CES2CES1
Palmitic Acid SCHEMBL10396224 0.98 FABP3 (0.55) FABP3CA1BBOX1CES2CES1
Myristic Acid SCHEMBL8588822 0.98 FABP3 (0.55) FABP3CA1BBOX1CES2CES1
Nonanoate SCHEMBL29370695 0.98 FABP3 (0.55) FABP3CA1BBOX1CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007079252-A2 SUSTAINED RELEASE PHARMACEUTICAL COMPOSITIONS AMPHASTAR PHARMACEUTICALS, INC. (US) 2007-07-12 WO disclosed
US-20070154546-A1 Sustained release pharmaceutical compositions INTERNATIONAL MEDICATION SYSTEMS, LIMITED 2007-07-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070154546-A1 Sustained release pharmaceutical compositions PLA2G2C, PLTP, F12 FABP3 510/4885CA1 221/4885BBOX1 4512/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.