SCHEMBL6442166

SCHEMBL6442166

CCCCCCCCCCCCCCCCCCP(=O)(O)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.64
CETP P11597 6/20 0.58
ALDH1A1 P00352 2/20 0.56
NPSR1 Q6W5P4 3/20 0.52
GAA P10253 1/20 0.52
MAPT P10636 1/20 0.52
ALPG P10696 1/20 0.52
ALOX12 P18054 1/20 0.52
NPY1R P25929 1/20 0.52
HTT P42858 1/20 0.52
NPY2R P49146 1/20 0.52
LPAR3 Q9UBY5 3/20 0.50
LPAR2 Q9HBW0 1/20 0.50
HIF1A Q16665 1/20 0.46
NAAA Q02083 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 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
SCHEMBL3817404 1.00 CFTR (0.64) CFTRCETPALDH1A1NPSR1GAA
SCHEMBL971677 1.00 CFTR (0.64) CFTRCETPALDH1A1NPSR1GAA
SCHEMBL6446482 1.00 CFTR (0.64) CFTRCETPALDH1A1NPSR1GAA
SCHEMBL6440843 1.00 CFTR (0.64) CFTRCETPALDH1A1NPSR1GAA
SCHEMBL18486462 1.00 CFTR (0.64) CFTRCETPALDH1A1NPSR1GAA
SCHEMBL7931533 1.00 CFTR (0.64) CFTRCETPALDH1A1NPSR1GAA
SCHEMBL17626558 0.98 CFTR (0.67) CFTRCETPALDH1A1NPSR1GAA
SCHEMBL972341 0.92 CFTR (0.69) CFTRCETPALDH1A1NPSR1GAA
SCHEMBL171269 0.90 CFTR (0.78) CFTRCETPALDH1A1NPSR1GAA
SCHEMBL14287997 0.88 CFTR (0.82) CFTRALDH1A1NPSR1GAAMAPT

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-6956072-B1 Thermoplastic resin composition and molded object thereof POLYPLASTICS CO., LTD. (JP) 2005-10-18 US disclosed