SCHEMBL28969148

SCHEMBL28969148

CCCCCCCCOP(N)(=O)OCCN

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 7/20 0.53
LPAR2 Q9HBW0 6/20 0.53
LPAR1 Q92633 3/20 0.53
CYP3A4 P08684 1/20 0.45
PLA2G2D Q9UNK4 1/20 0.44
PLA2G2C Q5R387 1/20 0.43
LMNA P02545 1/20 0.43
ESR1 P03372 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
CDC25A P30304 1/20 0.43
AGTR1 P30556 1/20 0.43
AKT1 P31749 1/20 0.43
ADRA1A P35348 1/20 0.43
KCNH2 Q12809 1/20 0.43
DNM1 Q05193 4/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
EPHX1 P07099 1/20 0.41

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
SCHEMBL9463219 0.92 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4LMNA
SCHEMBL29085821 0.92 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4LMNA
SCHEMBL17686773 0.92 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4LMNA
SCHEMBL393907 0.92 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4LMNA
SCHEMBL28954648 0.92 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4LMNA
SCHEMBL21764586 0.90 LPAR3 (0.59) LPAR3LPAR2LPAR1CYP3A4LMNA
SCHEMBL1194563 0.89 LPAR3 (0.58) LPAR3LPAR2LPAR1CYP3A4LMNA
SCHEMBL21764574 0.87 CYP3A4 (0.58) LPAR3LPAR2LPAR1CYP3A4LMNA
SCHEMBL31410773 0.86 CYP3A4 (0.64) LPAR3LPAR2LPAR1CYP3A4PLA2G2D
SCHEMBL28867255 0.86 CYP3A4 (0.64) LPAR3LPAR2LPAR1CYP3A4PLA2G2D

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-110444747-B High-performance carbon-coated metal phosphate nano material and preparation method and application thereof 盐城工学院 2023-03-21 CN disclosed