SCHEMBL22798370

SCHEMBL22798370

CCCCCCC=CCCCCCC(=O)O[C@H](CO)COP(=O)(O)O

nearest known ligand 0.93

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.93
LPAR1 Q92633 8/20 0.80
PRKCA P17252 2/20 0.73
PRKCE Q02156 1/20 0.73
PRKCQ Q04759 1/20 0.73
PRKCD Q05655 1/20 0.73
ENPP2 Q13822 4/20 0.70
LPAR3 Q9UBY5 5/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
DAGLA Q9Y4D2 1/20 0.66
LPAR4 Q99677 2/20 0.65
LPAR5 Q9H1C0 2/20 0.65
LPAR2 Q9HBW0 2/20 0.65
CES2 O00748 1/20 0.65
LPAR6 P43657 1/20 0.65
TRPV1 Q8NER1 1/20 0.65
GPR55 Q9Y2T6 2/20 0.62
SELP P16109 1/20 0.62

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
SCHEMBL29633539 1.00 S1PR1 (0.93) S1PR1LPAR1PRKCAPRKCEPRKCQ
SCHEMBL22798295 1.00 S1PR1 (0.93) S1PR1LPAR1PRKCAPRKCEPRKCQ
SCHEMBL22797755 1.00 S1PR1 (0.93) S1PR1LPAR1PRKCAPRKCEPRKCQ
SCHEMBL22798294 1.00 S1PR1 (0.93) S1PR1LPAR1PRKCAPRKCEPRKCQ
SCHEMBL22797758 1.00 S1PR1 (0.93) S1PR1LPAR1PRKCAPRKCEPRKCQ
SCHEMBL22798371 1.00 S1PR1 (0.93) S1PR1LPAR1PRKCAPRKCEPRKCQ
SCHEMBL29682271 0.93 S1PR1 (0.93) S1PR1LPAR1PRKCAPRKCEPRKCQ
SCHEMBL30653896 0.93 S1PR1 (0.80) S1PR1LPAR1PRKCAPRKCEPRKCQ
SCHEMBL30650456 0.93 S1PR1 (0.80) S1PR1LPAR1PRKCAPRKCEPRKCQ
SCHEMBL30649426 0.93 S1PR1 (0.80) S1PR1LPAR1PRKCAPRKCEPRKCQ

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-20250037787-A1 CONCENTRATION BOUNDS IN LARGE NETWORKS MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2025-01-30 US disclosed
EP-3753020-A1 CONCENTRATION BOUNDS IN LARGE NETWORKS Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2020-12-23 EP disclosed