SCHEMBL9714264

SCHEMBL9714264

CCCCCP(=O)(O)CC(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 3/20 0.52
LPAR2 Q9HBW0 1/20 0.52
CETP P11597 1/20 0.47
GABBR2 O75899 1/20 0.47
GABRR1 P24046 1/20 0.47
GABBR1 Q9UBS5 1/20 0.47
AKR1B1 P15121 1/20 0.44
PPARG P37231 5/20 0.43
PPARD Q03181 5/20 0.43
PPARA Q07869 5/20 0.43
HDAC11 Q96DB2 4/20 0.43
TSHR P16473 3/20 0.43
GPR84 Q9NQS5 3/20 0.43
ALDH1A1 P00352 2/20 0.43
TLR2 O60603 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
FABP4 P15090 2/20 0.43
PTPN1 P18031 2/20 0.43
SLC22A6 Q4U2R8 1/20 0.43
SLC22A8 Q8TCC7 1/20 0.43

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
SCHEMBL1315772 0.93 GABBR2 (0.54) LPAR3LPAR2CETPGABBR2GABRR1
SCHEMBL1313487 0.84 LMNA (0.48) LPAR3LPAR2GABBR2GABRR1GABBR1
SCHEMBL37982 0.81 LPAR3 (0.67) LPAR3LPAR2CETPGABBR2GABRR1
SCHEMBL338706 0.81 AKR1B1 (0.54) LPAR3LPAR2CETPAKR1B1PPARG
SCHEMBL7557652 0.80 LPAR3 (0.45) LPAR3LPAR2CETPGABBR2GABRR1
SCHEMBL9290884 0.79 GPR84 (0.56) LPAR3LPAR2CETPAKR1B1PPARG
SCHEMBL9290873 0.79 GPR84 (0.56) LPAR3LPAR2CETPAKR1B1PPARG
SCHEMBL339788 0.79 GPR84 (0.56) LPAR3LPAR2CETPAKR1B1PPARG
SCHEMBL9291138 0.79 GPR84 (0.56) LPAR3LPAR2CETPAKR1B1PPARG
SCHEMBL7095448 0.79 LPAR3 (0.71) LPAR3LPAR2CETPGABBR2GABRR1

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-5153347-A Phosphonate, phosphinate derivatives useful as antihypertensive agents E. R. SQUIBB & SONS, INC. (US) 1992-10-06 US disclosed