SCHEMBL4534560

SCHEMBL4534560

O=P(O)(O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCOP(=O)(O)O

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 11/20 0.61
LPAR2 Q9HBW0 7/20 0.61
LPAR1 Q92633 4/20 0.61
TYMS P04818 1/20 0.50
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
BBOX1 O75936 1/20 0.38
LPAR5 Q9H1C0 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
SCHEMBL4525000 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1TYMSLMNA
SCHEMBL4528434 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1TYMSLMNA
SCHEMBL4520064 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1TYMSLMNA
SCHEMBL4526628 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1TYMSLMNA
SCHEMBL4524581 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1TYMSLMNA
SCHEMBL4533913 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1TYMSLMNA
SCHEMBL4531985 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1TYMSLMNA
SCHEMBL4530294 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1TYMSLMNA
SCHEMBL4524705 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1TYMSLMNA
SCHEMBL4521703 1.00 LPAR3 (0.61) LPAR3LPAR2LPAR1TYMSLMNA

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