SCHEMBL4653151

SCHEMBL4653151

CCCCCCCCOC1(O)C=CC(C(=O)c2ccccc2)C(O)(O)C1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.40
LMNA P02545 3/20 0.36
ALDH1A1 P00352 2/20 0.36
TSHR P16473 2/20 0.36
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
KMT2A Q03164 1/20 0.36
NAAA Q02083 1/20 0.36
TP53 P04637 1/20 0.36
PPARG P37231 3/20 0.36
KDM4E B2RXH2 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
PLA2G4B P0C869 1/20 0.35
NR5A1 Q13285 1/20 0.35

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
SCHEMBL5688611 0.89 KCNH2 (0.40) KCNH2LMNAALDH1A1TSHRCES2
SCHEMBL28841075 0.80 KCNH2 (0.43) KCNH2LMNAALDH1A1CES2CES1
SCHEMBL5433591 0.75 KCNH2 (0.41) KCNH2LMNAALDH1A1TSHRCES2
SCHEMBL4748758 0.72 NPC1 (0.38) LMNAALDH1A1KMT2AHTT
SCHEMBL1906654 0.70 KCNH2 (0.38) KCNH2LMNAALDH1A1TSHRCES2
SCHEMBL30622138 0.70 NPC1 (0.37) LMNAALDH1A1TSHRCES1KMT2A
SCHEMBL11333120 0.70 TSHR (0.40) KCNH2LMNAALDH1A1TSHRCES2
SCHEMBL15353512 0.70 TSHR (0.40) KCNH2LMNAALDH1A1TSHRCES2
SCHEMBL14957998 0.69 TSHR (0.37) LMNAALDH1A1TSHRCES2CES1
SCHEMBL5433594 0.69 TSHR (0.37) LMNAALDH1A1TSHRCES2CES1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1505412-B1 Plastic lens and process for producing the lens HOYA CORP (JP) 2008-11-05 EP disclosed
EP-1505412-A1 Plastic lens and process for producing the lens HOYA CORPORATION (JP) 2005-02-09 EP disclosed