SCHEMBL17060908

SCHEMBL17060908

CC(CO)C1CCCCCCCCC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.44
TP53 P04637 1/20 0.41
KDM4E B2RXH2 1/20 0.39
GMNN O75496 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
BLM P54132 1/20 0.39
PMP22 Q01453 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
EPHX1 P07099 3/20 0.39

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
SCHEMBL12806278 1.00 SHBG (0.44) SHBGTP53KDM4EGMNNLMNA
SCHEMBL9921613 1.00 SHBG (0.44) SHBGTP53KDM4EGMNNLMNA
SCHEMBL295725 1.00 SHBG (0.44) SHBGTP53KDM4EGMNNLMNA
SCHEMBL9819929 1.00 SHBG (0.44) SHBGTP53KDM4EGMNNLMNA
SCHEMBL295412 1.00 SHBG (0.44) SHBGTP53KDM4EGMNNLMNA
SCHEMBL9898281 1.00 SHBG (0.44) SHBGTP53KDM4EGMNNLMNA
SCHEMBL20627575 0.97
SCHEMBL8671923 0.97
Alcohol SCHEMBL5313946 0.95 SHBG (0.46) SHBGTP53KDM4EGMNNLMNA
SCHEMBL6092895 0.92

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
EP-2306820-B1 COMPOSITIONS COMPRISING A BENZYL ALCOHOL DERIVATIVE AND FURTHER ANTIMICROBIAL ACTIVE COMPOUNDS SYMRISE AG (DE) 2015-09-09 EP disclosed