SCHEMBL25588992

SCHEMBL25588992

CCCCCCCCCCC[C@H]1OC[C@@H](COS(=O)(=O)O)CO1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 12/20 0.44
LPAR2 Q9HBW0 8/20 0.44
ALDH1A1 P00352 2/20 0.43
TDP1 Q9NUW8 1/20 0.38
PRKD3 O94806 2/20 0.37
PRKCG P05129 2/20 0.37
PRKCB P05771 2/20 0.37
PRKCA P17252 2/20 0.37
PRKCH P24723 2/20 0.37
PRKCI P41743 2/20 0.37
PRKCE Q02156 2/20 0.37
PRKCQ Q04759 2/20 0.37
PRKCZ Q05513 2/20 0.37
PRKCD Q05655 2/20 0.37
PRKD1 Q15139 2/20 0.37

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
SCHEMBL25724647 1.00 ENPP2 (0.44) ENPP2LPAR2ALDH1A1TDP1PRKD3
SCHEMBL25215389 0.84 ENPP2 (0.59) ENPP2LPAR2ALDH1A1PRKD3PRKCG
SCHEMBL25422178 0.84 ENPP2 (0.59) ENPP2LPAR2ALDH1A1PRKD3PRKCG
SCHEMBL25421037 0.84 ENPP2 (0.59) ENPP2LPAR2ALDH1A1PRKD3PRKCG
SCHEMBL25421986 0.84 ENPP2 (0.59) ENPP2LPAR2ALDH1A1PRKD3PRKCG
SCHEMBL25217057 0.84 ENPP2 (0.59) ENPP2LPAR2ALDH1A1PRKD3PRKCG
SCHEMBL25251802 0.79 ALDH1A1 (0.46) ENPP2LPAR2ALDH1A1TDP1PRKD3
SCHEMBL25277125 0.79 ALDH1A1 (0.46) ENPP2LPAR2ALDH1A1TDP1PRKD3
SCHEMBL25226402 0.79 ALDH1A1 (0.46) ENPP2LPAR2ALDH1A1TDP1PRKD3
SCHEMBL25222402 0.79 ALDH1A1 (0.46) ENPP2LPAR2ALDH1A1TDP1PRKD3

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
US-20230174897-A1 LIQUID HAND DISHWASHING DETERGENT COMPOSITION THE PROCTER & GAMBLE COMPANY 2023-06-08 US disclosed
US-20230174897-A1 LIQUID HAND DISHWASHING DETERGENT COMPOSITION THE PROCTER & GAMBLE COMPANY 2023-06-08 US disclosed