SCHEMBL9517306

SCHEMBL9517306

CCCCCCC(CCCCCCCCCCC(=O)OCCCCCCCCCCCCCCCC(C)C)C(=O)CCCCCCCCCCCCCCC(C)C

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.56
PRSS1 P07477 1/20 0.49
PRSS2 P07478 1/20 0.49
PRSS3 P35030 1/20 0.49
MAPT P10636 1/20 0.49
DNM1 Q05193 1/20 0.48
NAAA Q02083 1/20 0.47
HTR2C P28335 1/20 0.47
LMNA P02545 3/20 0.45
PLA2G2A P14555 2/20 0.45
ALDH1A1 P00352 1/20 0.44
PAM P19021 2/20 0.44
KDM4E B2RXH2 1/20 0.43
DUSP3 P51452 1/20 0.43

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
SCHEMBL27659710 1.00 DGKA (0.56) DGKAPRSS1PRSS2PRSS3MAPT
SCHEMBL2193854 1.00 DGKA (0.56) DGKAPRSS1PRSS2PRSS3MAPT
SCHEMBL3927345 0.95 DGKA (0.50) DGKAPRSS1PRSS2PRSS3MAPT
SCHEMBL27960835 0.94 DGKA (0.62) DGKAPRSS1PRSS2PRSS3MAPT
SCHEMBL2196519 0.94 DGKA (0.62) DGKAPRSS1PRSS2PRSS3MAPT
SCHEMBL79881 0.91 DGKA (0.67) DGKAPRSS1PRSS2PRSS3MAPT
SCHEMBL21723086 0.91 DGKA (0.67) DGKAPRSS1PRSS2PRSS3MAPT
SCHEMBL1224927 0.91 DGKA (0.67) DGKAPRSS1PRSS2PRSS3MAPT
SCHEMBL22730172 0.91 DGKA (0.67) DGKAPRSS1PRSS2PRSS3MAPT
SCHEMBL21384818 0.91 DGKA (0.67) DGKAPRSS1PRSS2PRSS3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2273645-A None JP disclosed
EP-0389269-B1 DIESTERS AND THEIR USE IN WAXES UNICHEMA CHEMIE B.V. (NL) 1993-05-26 EP disclosed
US-5104586-A Having branched saturated hydrocarbon chains; for cosmetic emulsions UNILEVER PATENT HOLDINGS B.V. (NL) 1992-04-14 US disclosed
JP-H02273645-A DIESTER AND USE THEREOF IN WAX UNILEVER NV 1990-11-08 JP disclosed
EP-0389269-A1 Diesters and their use in waxes UNICHEMA CHEMIE B.V. (NL) 1990-09-26 EP disclosed