SCHEMBL6798446

SCHEMBL6798446

CCCCCCCCC=CCCCCCCCCOCC(COCCCCCCCCC=CCCCCCCCC)OC(C)=O

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 2/20 0.55
LPAR3 Q9UBY5 2/20 0.55
ADRA1D P25100 1/20 0.53
PTAFR P25105 1/20 0.53
HTR1D P28221 1/20 0.53
HTR2C P28335 1/20 0.53
ADRA1B P35368 1/20 0.53
DRD3 P35462 1/20 0.53
TMEM97 Q5BJF2 1/20 0.53
PRKCA P17252 1/20 0.52
ALDH1A1 P00352 1/20 0.48

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
SCHEMBL6798442 1.00 LPAR1 (0.55) LPAR1LPAR3ADRA1DPTAFRHTR1D
SCHEMBL1506794 0.94 PRKCA (0.61) LPAR1LPAR3ADRA1DPTAFRHTR1D
SCHEMBL1506792 0.94 PRKCA (0.61) LPAR1LPAR3ADRA1DPTAFRHTR1D
SCHEMBL4912512 0.93 PRKCA (0.62) LPAR1LPAR3PRKCAALDH1A1
SCHEMBL1000470 0.93 PRKCA (0.62) LPAR1LPAR3PRKCAALDH1A1
SCHEMBL10896003 0.93 PRKCA (0.62) LPAR1LPAR3PRKCAALDH1A1
SCHEMBL4912502 0.93 PRKCA (0.62) LPAR1LPAR3PRKCAALDH1A1
Hydrochloric Acid SCHEMBL9645000 0.88 LPAR1 (0.47) LPAR1LPAR3ADRA1DPTAFRHTR1D
SCHEMBL6789092 0.86 LPAR1 (0.53) LPAR1LPAR3PRKCAALDH1A1
SCHEMBL6789101 0.86 LPAR1 (0.53) LPAR1LPAR3PRKCAALDH1A1

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-20040086621-A1 Reduced calorie fat KRAFT FOODS HOLDINGS, INC. 2004-05-06 US disclosed