SCHEMBL4518749

SCHEMBL4518749

NCCCCCCCCCCCCCCCCCCCCCCCCCOP(=O)(O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 8/20 0.61
LPAR2 Q9HBW0 6/20 0.61
LPAR1 Q92633 4/20 0.61
FDPS P14324 2/20 0.43
ITPR3 Q14573 1/20 0.43
ITPR1 Q14643 1/20 0.43
LMNA P02545 1/20 0.42
CYP3A4 P08684 1/20 0.42
NFKB1 P19838 1/20 0.42
BLM P54132 1/20 0.42
PMP22 Q01453 1/20 0.42
GABBR2 O75899 1/20 0.39
CYP1A2 P05177 1/20 0.39
TSHR P16473 1/20 0.39
THPO P40225 1/20 0.39
GABBR1 Q9UBS5 1/20 0.39
DNM1 Q05193 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 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
SCHEMBL4527399 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1FDPSITPR3
SCHEMBL4538834 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1FDPSITPR3
SCHEMBL4539050 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1FDPSITPR3
SCHEMBL4526591 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1FDPSITPR3
SCHEMBL4521470 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1FDPSITPR3
SCHEMBL28707 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1FDPSITPR3
SCHEMBL4529975 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1FDPSITPR3
SCHEMBL4539600 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1FDPSITPR3
SCHEMBL4532688 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1FDPSITPR3
SCHEMBL4528979 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1FDPSITPR3

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-20090123516-A1 DRUG DELIVERY FROM IMPLANTS USING SELF-ASSEMBLED MONOLAYERS-THERAPEUTIC SAMS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2009-05-14 US disclosed
WO-2007019478-A2 DRUG DELIVERY FROM IMPLANTS USING SELF-ASSEMBLED MONOLAYERS - THERAPEUTIC SAMS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2007-02-15 WO disclosed