Sugi Predict

Sugi Predict / Compounds / SCHEMBL14780582

SCHEMBL14780582

SCHEMBL14780582

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(CC)C(=O)OCC(COP(=O)(O)OCCC)OC(=O)C(CC)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SELP P16109 1/20 0.43
▸ NR5A2 O00482 1/20 0.38
▸ NR5A1 Q13285 1/20 0.38
▸ FABP3 P05413 1/20 0.37
▸ S1PR1 P21453 1/20 0.36
▸ GPR55 Q9Y2T6 2/20 0.36
▸ P2RY10 O00398 4/20 0.34
▸ LPAR1 Q92633 1/20 0.34
▸ LPAR3 Q9UBY5 1/20 0.34
▸ GPR34 Q9UPC5 1/20 0.34

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
SCHEMBL13491205 0.90 FABP3 (0.48) SELPNR5A2NR5A1FABP3GPR55
SCHEMBL3208533 0.85 ADORA3 (0.40) FABP3
SCHEMBL13491206 0.84 S1PR1 (0.41) SELPS1PR1GPR55P2RY10GPR34
SCHEMBL3226515 0.84 S1PR1 (0.41) SELPS1PR1GPR55P2RY10GPR34
SCHEMBL19821334 0.80 SELP (0.60) SELPNR5A2NR5A1FABP3S1PR1
SCHEMBL3204906 0.79 ALDH1A1 (0.53) NR5A2NR5A1
SCHEMBL14207527 0.78 GPR55 (0.39) SELPGPR55P2RY10LPAR1LPAR3
SCHEMBL17484940 0.76 SELP (0.72) SELPNR5A2NR5A1FABP3S1PR1
SCHEMBL13491287 0.75 ADORA3 (0.36) —
SCHEMBL16864118 0.75 SELP (0.70) SELPNR5A2NR5A1FABP3S1PR1

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-8399516-B2 Alpha-substituted omega-3 lipids that are activators or modulators of the peroxisome proliferators-activated receptor (PPAR) PRONOVA BIOPHARMA NORGE AS (NO) 2013-03-19 — — US disclosed