SCHEMBL6300601

SCHEMBL6300601

CC(C)(C)OC(=O)C1CC2C=CC1CCCCCCCCCCC2

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
EPHX1 P07099 2/20 0.32
ALDH1A1 P00352 3/20 0.32
MAPK1 P28482 1/20 0.31
SLC6A2 P23975 1/20 0.31
PDE4B Q07343 1/20 0.31
HPGD P15428 2/20 0.31
BTK Q06187 1/20 0.31
POLB P06746 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30

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
SCHEMBL7641822 0.89 ALDH1A1 (0.36) KDM4ELMNAALDH1A1MAPK1HPGD
SCHEMBL30862606 0.82 KDM4E (0.49) KDM4ELMNAALDH1A1MAPK1HPGD
SCHEMBL525537 0.82 KDM4E (0.49) KDM4ELMNAALDH1A1MAPK1HPGD
SCHEMBL14534917 0.82 KDM4E (0.49) KDM4ELMNAALDH1A1MAPK1HPGD
SCHEMBL14628488 0.82 KDM4E (0.49) KDM4ELMNAALDH1A1MAPK1HPGD
SCHEMBL22263836 0.77 LMNA (0.41) KDM4ELMNAALDH1A1MAPK1HPGD
SCHEMBL525442 0.77 LMNA (0.41) KDM4ELMNAALDH1A1MAPK1HPGD
SCHEMBL2206146 0.75 KDM4E (0.39) KDM4ELMNAALDH1A1POLB
SCHEMBL22263881 0.75 LMNA (0.41) KDM4ELMNAALDH1A1MAPK1HPGD
SCHEMBL22263654 0.75 LMNA (0.41) KDM4ELMNAALDH1A1MAPK1HPGD

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-6846895-B2 Polysiloxane, method of manufacturing same, silicon-containing alicyclic compound, and radiation-sensitive resin composition JSR CORPORATION (JP) 2005-01-25 US disclosed