SCHEMBL28148255

SCHEMBL28148255

OCCCC(O)=C(CO)CCO

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CAMK2A Q9UQM7 1/20 0.39
GPR84 Q9NQS5 1/20 0.31
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31

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
SCHEMBL25312367 0.69
SCHEMBL11451699 0.68 TSHR (0.31)
SCHEMBL15462382 0.65
SCHEMBL6434673 0.63
SCHEMBL6437152 0.63
SCHEMBL7525318 0.63 TSHR (0.40)
Ammonia Solution, Strong SCHEMBL5405105 0.60 TSHR (0.36)
Oxybate SCHEMBL8096046 0.59 CAMK2A (0.88) CAMK2AGPR84FFAR1FFAR4
Oxybate SCHEMBL4180417 0.59 CAMK2A (0.88) CAMK2AGPR84FFAR1FFAR4
Oxybate SCHEMBL28454779 0.59

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
CN-206204184-U The continuous production butylene glycol coproduction butanediol system of butynediols hydrogenation 查都(上海)科技有限公司 2017-05-31 CN disclosed