Behenic Acid

Behenic Acid

SCHEMBL8991179

CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].O=C([O-])c1ccccc1.[Al+2]

nearest known ligand 0.63

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Known targets — ChEMBL curated mechanism

CACNA1CCACNA1DCACNA1FCACNA1SDPP4HTR1BHTR1D

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 7)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.63
CES1 P23141 4/20 0.63
CA2 P00918 1/20 0.52
CA4 P22748 1/20 0.52
FABP3 P05413 7/20 0.50
NAAA Q02083 1/20 0.49
PPARG P37231 1/20 0.48

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
Stearic Acid SCHEMBL3527614 1.00 CES2 (0.63) CES2CES1CA2CA4FABP3
Palmitic Acid SCHEMBL7107501 0.97 CES2 (0.63) CES2CES1CA2CA4FABP3
Stearic Acid SCHEMBL3527610 0.97 CES2 (0.63) CES2CES1CA2CA4FABP3
Stearic Acid SCHEMBL11855074 0.97 CES2 (0.63) CES2CES1CA2CA4FABP3
Stearic Acid SCHEMBL9785245 0.97 CES2 (0.63) CES2CES1CA2CA4FABP3
Stearic Acid SCHEMBL5271199 0.97 CES2 (0.63) CES2CES1CA2CA4FABP3
Stearic Acid SCHEMBL11512773 0.97 CES2 (0.63) CES2CES1CA2CA4FABP3
Behenic Acid SCHEMBL8991167 0.97 CES2 (0.63) CES2CES1CA2CA4FABP3
Behenic Acid SCHEMBL4587443 0.97 CES2 (0.63) CES2CES1CA2CA4FABP3
Dodecanoate SCHEMBL15375235 0.97 CES2 (0.63) CES2CES1CA2CA4FABP3

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
EP-0160778-B2 Waterproof optical fiber cable MITSUBISHI CABLE IND LTD (JP) 1996-07-24 EP disclosed
EP-0160778-B1 WATERPROOF OPTICAL FIBER CABLE Mitsubishi Cable Industries, Ltd. (JP) 1989-10-04 EP disclosed
US-4703997-A FILLED WITH GREASE DAINICHI-NIPPON CABLES, LTD. (JP) 1987-11-03 US disclosed
EP-0160778-A1 Waterproof optical fiber cable Mitsubishi Cable Industries, Ltd. (JP) 1985-11-13 EP disclosed