SCHEMBL4483584

SCHEMBL4483584

CCCCCCCCCCCCCCCCCCOCCCOP(=O)(O)C(=O)OCC

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 11/20 0.51
LPAR2 Q9HBW0 7/20 0.51
LPAR1 Q92633 6/20 0.51
P2RY10 O00398 1/20 0.47
LPAR5 Q9H1C0 1/20 0.44
CES2 O00748 1/20 0.42
MEN1 O00255 1/20 0.41
THRB P10828 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 1/20 0.41
PLA2G2A P14555 1/20 0.40

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
SCHEMBL12354844 0.81 LPAR1 (0.59) LPAR3LPAR2LPAR1LPAR5MEN1
SCHEMBL28798792 0.79 LPAR3 (0.39) LPAR3LPAR2LPAR1MEN1KMT2A
SCHEMBL29026510 0.78 LPAR3 (0.84) LPAR3LPAR2LPAR1P2RY10LPAR5
SCHEMBL29026467 0.78 LPAR3 (0.84) LPAR3LPAR2LPAR1P2RY10LPAR5
SCHEMBL18444519 0.78 LPAR3 (0.84) LPAR3LPAR2LPAR1P2RY10LPAR5
SCHEMBL28783278 0.78 CYP3A4 (0.50) LPAR3LPAR2LPAR1
SCHEMBL4483106 0.78 LPAR3 (0.84) LPAR3LPAR2LPAR1P2RY10LPAR5
SCHEMBL4247095 0.78 LPAR3 (0.84) LPAR3LPAR2LPAR1P2RY10LPAR5
SCHEMBL2379995 0.78 LPAR3 (0.84) LPAR3LPAR2LPAR1P2RY10LPAR5
SCHEMBL6810040 0.78 LPAR3 (0.84) LPAR3LPAR2LPAR1P2RY10LPAR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7517858-B1 Prodrugs of pharmaceuticals with improved bioavailability THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-04-14 US disclosed
EP-0837630-B1 PRODRUGS OF PHARMACEUTICALS WITH IMPROVED BIOAVAILABILITY HOSTETLER KARL Y (US) 2007-12-26 EP disclosed
EP-0837630-A4 PRODRUGS OF PHARMACEUTICALS WITH IMPROVED BIOAVAILABILITY UNIV CALIFORNIA (US) 1998-11-25 EP disclosed
EP-0837630-A1 PRODRUGS OF PHARMACEUTICALS WITH IMPROVED BIOAVAILABILITY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1998-04-29 EP disclosed
WO-1996039831-A1 PRODRUGS OF PHARMACEUTICALS WITH IMPROVED BIOAVAILABILITY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1996-12-19 WO disclosed