SCHEMBL11580702

SCHEMBL11580702

OCCC1=CCCCC=C1CCO

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ALOX5 P09917 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
BACE1 P56817 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL11578490 0.88 TDP1 (0.33) KDM4EALDH1A1ALOX5GAAMAPT
SCHEMBL11105828 0.70
SCHEMBL11579520 0.69
SCHEMBL18022809 0.69 GSTP1 (0.31)
SCHEMBL9612797 0.69
SCHEMBL5864384 0.69
SCHEMBL953643 0.67
SCHEMBL11316288 0.65 SMN1; SMN2 (0.46) KDM4EALDH1A1MAPT
SCHEMBL11316294 0.65 SMN1; SMN2 (0.46) KDM4EALDH1A1MAPT
SCHEMBL10877304 0.65 SMN1; SMN2 (0.46) KDM4EALDH1A1MAPT

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
US-4098881-A COMPOSITIONS TO CONTROL THE CHRONIC EFFECTS OF EXPOSURE TO SUNLIGHT COMPRISING CONJUGATED DIENES THE PROCTER & GAMBLE COMPANY (US) 1978-07-04 US claimed
US-4098881-A COMPOSITIONS TO CONTROL THE CHRONIC EFFECTS OF EXPOSURE TO SUNLIGHT COMPRISING CONJUGATED DIENES THE PROCTER & GAMBLE COMPANY (US) 1978-07-04 US disclosed