SCHEMBL29313368

SCHEMBL29313368

CCOCCCCCC(=O)CCCCCOCC=O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.39
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
CES2 O00748 2/20 0.35
ALDH1A1 P00352 2/20 0.34
TSHR P16473 2/20 0.34
PLA2G4B P0C869 1/20 0.33
DGKA P23743 1/20 0.32
GAA P10253 1/20 0.32
FAAH O00519 1/20 0.32

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
SCHEMBL25996478 0.87 MAPT (0.46) EPHX2MAPTKMT2ACES2ALDH1A1
SCHEMBL13485232 0.84 ALDH1A1 (0.36) EPHX2CES2ALDH1A1TSHR
SCHEMBL25996476 0.84 ALDH1A1 (0.44) EPHX2MAPTKMT2ACES2ALDH1A1
SCHEMBL1714428 0.84 MAPT (0.40) EPHX2MAPTKMT2AALDH1A1TSHR
SCHEMBL1714938 0.84 MAPT (0.40) EPHX2MAPTKMT2AALDH1A1TSHR
SCHEMBL26016106 0.79 EPHX2 (0.44) EPHX2MAPTKMT2ACES2ALDH1A1
SCHEMBL16500239 0.79 EPHX2 (0.44) EPHX2MAPTKMT2ACES2ALDH1A1
SCHEMBL1713806 0.78 MAPT (0.41) EPHX2MAPTKMT2AALDH1A1TSHR
SCHEMBL29313363 0.77 FFAR4 (0.36) CES2ALDH1A1FAAH
Dodecanoate SCHEMBL28724444 0.77 GPR84 (0.59) MAPTKMT2AALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4003314-B1 FUNCTIONALIZED LONG-CHAIN HYDROCARBON MONO- AND DI-CARBOXYLIC ACIDS USEFUL FOR THE PREVENTION OR TREATMENT OF DISEASE ESPERVITA THERAPEUTICS INC (US) 2024-07-10 EP disclosed