SCHEMBL11040069

SCHEMBL11040069

CCCCCCOP(=O)(OCCCCCC)C(N)CCCN

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LAP3 P28838 2/20 0.47
LPAR3 Q9UBY5 6/20 0.46
LPAR2 Q9HBW0 5/20 0.46
LPAR1 Q92633 2/20 0.46
DNM1 Q05193 4/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
EPHX1 P07099 1/20 0.39
CYP3A4 P08684 1/20 0.38
LMNA P02545 1/20 0.38
ESR1 P03372 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
CDC25A P30304 1/20 0.38
AGTR1 P30556 1/20 0.38
AKT1 P31749 1/20 0.38
ADRA1A P35348 1/20 0.38
KCNH2 Q12809 1/20 0.38
FDPS P14324 1/20 0.38

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
SCHEMBL19349539 0.91 LAP3 (0.56) LAP3LPAR3LPAR2LPAR1CYP3A4
SCHEMBL7114499 0.91 LAP3 (0.56) LAP3LPAR3LPAR2LPAR1CYP3A4
SCHEMBL29098445 0.85 LAP3 (0.44) LAP3LPAR3LPAR2LPAR1DNM1
SCHEMBL4158111 0.79 LAP3 (0.58) LAP3FDPS
SCHEMBL19955270 0.79 LAP3 (0.58) LAP3FDPS
SCHEMBL10384012 0.77 LAP3 (0.57) LAP3FDPS
SCHEMBL28056121 0.76 CYP3A4 (0.46) LAP3LPAR3LPAR2LPAR1ALDH1A1
SCHEMBL28392505 0.76 CYP3A4 (0.45) LAP3LPAR3LPAR2LPAR1TSHR
Octadecylamine SCHEMBL31542019 0.74 CYP3A4 (0.64) LPAR3LPAR2LPAR1DNM1MEN1
SCHEMBL3122516 0.74 LAP3 (0.48) LAP3TSHRCYP3A4FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0028866-B1 STABILISED AQUEOUS ENZYME COMPOSITION CONTAINING FORMATE AND CALCIUM IONS THE PROCTER & GAMBLE COMPANY (US) 1984-07-11 EP disclosed
EP-0028866-A1 Stabilised aqueous enzyme composition containing formate and calcium ions THE PROCTER & GAMBLE COMPANY (US) 1981-05-20 EP disclosed
EP-0028865-A1 Homogeneous enzyme-containing liquid detergent compositions containing saturated fatty acids THE PROCTER & GAMBLE COMPANY (US) 1981-05-20 EP disclosed