SCHEMBL29209337

SCHEMBL29209337

CCCCc1cccc(OP(=O)(O)Oc2cccc(CCCC)c2)c1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 5/20 0.52
PPARG P37231 4/20 0.52
GGPS1 O95749 2/20 0.49
PLK1 P53350 1/20 0.48
CETP P11597 1/20 0.47
CYP2D6 P10635 1/20 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
SCHEMBL11849637 0.94 PPARA (0.60) PPARAPPARGGGPS1PLK1CETP
SCHEMBL29648269 0.91 PLK1 (0.57) PPARAPPARGGGPS1PLK1CETP
SCHEMBL8956463 0.88 PPARA (0.54) PPARAPPARGGGPS1PLK1CETP
SCHEMBL1788069 0.87 PPARA (0.51) PPARAPPARGGGPS1PLK1
SCHEMBL15049836 0.86 PLK1 (0.62) PPARAPPARGGGPS1PLK1CETP
Butylbenzyl SCHEMBL28433300 0.86 CETP (0.53) CETP
SCHEMBL15638466 0.85 PLK1 (0.65) PPARAPPARGGGPS1PLK1CETP
SCHEMBL10901213 0.84 PLK1 (0.63) PPARAPPARGGGPS1PLK1CETP
SCHEMBL10901224 0.84 PLK1 (0.63) PPARAPPARGGGPS1PLK1CETP
SCHEMBL11857240 0.83 PTGS2 (0.44) PPARAPPARGGGPS1PLK1CETP

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
CN-117716297-A Diluent composition and method for manufacturing semiconductor device using the same 三菱瓦斯化学株式会社 2024-03-15 CN disclosed