SCHEMBL8413985

SCHEMBL8413985

CCCCCCCCCCCCCCCCCCCCOC(C)(O[PH](=O)O)[PH](C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 3/20 0.38
LPAR1 Q92633 2/20 0.38
LPAR2 Q9HBW0 2/20 0.38
CES2 O00748 2/20 0.37
CA1 P00915 8/20 0.34
CA2 P00918 8/20 0.34
CA9 Q16790 7/20 0.34
CA12 O43570 3/20 0.34
CA7 P43166 3/20 0.34
CA14 Q9ULX7 3/20 0.34
CA3 P07451 2/20 0.34
CA4 P22748 2/20 0.34
CA6 P23280 2/20 0.34
CA5A P35218 2/20 0.34
CA5B Q9Y2D0 2/20 0.34
NAAA Q02083 1/20 0.34
RECQL P46063 2/20 0.33
GLA P06280 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL8416960 1.00 LPAR3 (0.38) LPAR3LPAR1LPAR2CES2CA1
SCHEMBL8416925 1.00 LPAR3 (0.38) LPAR3LPAR1LPAR2CES2CA1
SCHEMBL8416882 1.00 LPAR3 (0.38) LPAR3LPAR1LPAR2CES2CA1
SCHEMBL8413575 0.91 LPAR3 (0.43) LPAR3LPAR1LPAR2RECQLBLM
SCHEMBL8415252 0.82 LPAR3 (0.37) LPAR3LPAR1LPAR2CES2CA1
SCHEMBL8415907 0.82 LPAR3 (0.37) LPAR3LPAR1LPAR2CES2CA1
SCHEMBL8415255 0.75 LPAR3 (0.42) LPAR3LPAR1LPAR2RECQLBLM
SCHEMBL5430404 0.73 ALDH1A1 (0.34) LPAR3LPAR1LPAR2HPGDTSHR
SCHEMBL8416907 0.72 LPAR3 (0.37) LPAR3LPAR1LPAR2CES2NAAA
SCHEMBL8415887 0.72 LPAR3 (0.37) LPAR3LPAR1LPAR2CES2NAAA

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
US-5958906-A Phospholipid derivatives containing higher elements of the fifth main group ASTA-MEDICA AKTIENGESELLSCHAFT (DE) 1999-09-28 US disclosed