SCHEMBL8022735

SCHEMBL8022735

CCCCCCCCCCCCCCCCOP(=O)(O)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 8/20 0.64
LPAR2 Q9HBW0 6/20 0.64
LPAR1 Q92633 3/20 0.64
ESR1 P03372 2/20 0.47
LMNA P02545 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
CDC25A P30304 1/20 0.47
AGTR1 P30556 1/20 0.47
AKT1 P31749 1/20 0.47
ADRA1A P35348 1/20 0.47
KCNH2 Q12809 1/20 0.47
PPARG P37231 5/20 0.45
PPARD Q03181 5/20 0.45
PPARA Q07869 5/20 0.45
HDAC11 Q96DB2 4/20 0.45
TSHR P16473 3/20 0.45
GPR84 Q9NQS5 3/20 0.45
ALDH1A1 P00352 2/20 0.45
TLR2 O60603 2/20 0.45
TDP1 Q9NUW8 2/20 0.45

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
SCHEMBL18614738 0.98 LPAR3 (0.61) LPAR3LPAR2LPAR1ESR1LMNA
SCHEMBL8465666 0.92 CYP3A4 (0.54) LPAR3LPAR2LPAR1TSHRALDH1A1
SCHEMBL16996791 0.84 LPAR3 (0.64) LPAR3LPAR2LPAR1ESR1LMNA
SCHEMBL16996796 0.84 LPAR3 (0.64) LPAR3LPAR2LPAR1ESR1LMNA
SCHEMBL16996793 0.84 LPAR3 (0.64) LPAR3LPAR2LPAR1ESR1LMNA
SCHEMBL16996799 0.82 LPAR3 (0.61) LPAR3LPAR2LPAR1ESR1LMNA
SCHEMBL3299092 0.81 LPAR3 (0.95) LPAR3LPAR2LPAR1ESR1LMNA
Stearic Acid SCHEMBL2349963 0.79 GPR84 (0.61) LPAR3LPAR2LPAR1ESR1PPARG
SCHEMBL3486031 0.79 GPR84 (0.61) LPAR3LPAR2LPAR1ESR1PPARG
SCHEMBL3485308 0.79 GPR84 (0.61) LPAR3LPAR2LPAR1ESR1PPARG

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-6136797-A PHOSPHATIDES AS VIRAL AGENTS HEIDELBERG PHARMA HOLDING GMBH (DE) 2000-10-24 US disclosed
US-5955452-A LIPIDS AS VIRICIDES ROCHE DIAGNOSTICS GMBH (DE) 1999-09-21 US disclosed