SCHEMBL13745756

SCHEMBL13745756

O=C1OC2(CCCCC2)OC(=O)C1=C/C=C(/C=C/C1C(=O)OC2(CCCCC2)OC1=O)C1=CC=CCC1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.31
▸ KDM4E B2RXH2 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
SCHEMBL14374890 0.86 — —
SCHEMBL13908751 0.86 — —
SCHEMBL13479237 0.80 KDM4E (0.32) ALDH1A1KDM4E
SCHEMBL13943917 0.72 ALDH1A1 (0.31) ALDH1A1KDM4E
SCHEMBL13486727 0.66 ALDH1A1 (0.34) ALDH1A1KDM4E
SCHEMBL13741193 0.60 — —
SCHEMBL14574036 0.59 ALDH1A1 (0.47) ALDH1A1KDM4E
SCHEMBL12715721 0.59 ALDH1A1 (0.39) ALDH1A1KDM4E
SCHEMBL13967308 0.59 ALDH1A1 (0.39) ALDH1A1KDM4E
SCHEMBL14015307 0.58 ALDH1A1 (0.41) ALDH1A1KDM4E

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-20090196141-A1 OPTICAL RECORDING MEDIUM, METHOD FOR UTILIZING DYE COMPOUND AND VISIBLE INFORMATION RECORDING METHOD FUJIFILM CORPORATION (JP) 2009-08-06 — — US disclosed
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