SCHEMBL9237687

SCHEMBL9237687

C=C(C)C(=O)C=CCOP(=O)(O)O

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
LPAR3 Q9UBY5 5/20 0.34
LPAR2 Q9HBW0 4/20 0.34
BTN3A1 O00481 3/20 0.34
FNTA P49354 4/20 0.33
FNTB P49356 4/20 0.33
LPAR1 Q92633 2/20 0.32
TPI1 P60174 1/20 0.31

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
SCHEMBL2898818 0.75 ALDH1A1 (0.33) ALDH1A1LPAR3LPAR2BTN3A1FNTA
SCHEMBL5571318 0.74 TSHR (0.41) LPAR3LPAR2LPAR1TPI1
SCHEMBL7639271 0.72 LPAR3 (0.40) LPAR3LPAR2BTN3A1FNTAFNTB
Methacrylic Acid SCHEMBL3464507 0.72 FNTA (0.40) LPAR3LPAR2BTN3A1FNTAFNTB
SCHEMBL9048769 0.70 ALDH1A1 (0.50) ALDH1A1
SCHEMBL14541957 0.69
SCHEMBL9078846 0.69
SCHEMBL13268920 0.69
SCHEMBL1506680 0.69
SCHEMBL11260859 0.67

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-5441861-A Contains color coupler distributed in a polymeric oil former and a bisphenol compound; improved color stability AGFA-GEVAERT AB (DE) 1995-08-15 US disclosed