SCHEMBL7977224

SCHEMBL7977224

COc1c2c(c(OC)c(OC)c1OC)CCC(=CCOC(C)=O)CC2

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
ALOX15 P16050 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
SCHEMBL4693468 0.77 ALDH1A1 (0.36) ALDH1A1ALOX15
SCHEMBL4689856 0.75 ALDH1A1 (0.35) ALDH1A1ALOX15
SCHEMBL15802621 0.75 ALDH1A1 (0.35) ALDH1A1ALOX15
SCHEMBL4690823 0.73 CHRM1 (0.34) ALDH1A1ALOX15
SCHEMBL22615936 0.69 ALDH1A1 (0.31) ALDH1A1ALOX15
SCHEMBL27637712 0.67 ALDH1A1 (0.34) ALDH1A1ALOX15
SCHEMBL27637713 0.67 ALDH1A1 (0.34) ALDH1A1ALOX15
SCHEMBL28754649 0.67 ALDH1A1 (0.34) ALDH1A1ALOX15
SCHEMBL28571856 0.67 PRKCA (0.32) ALDH1A1ALOX15
SCHEMBL28571854 0.67 PRKCA (0.32) ALDH1A1ALOX15

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-6326369-B1 ALZHEIMER'S DISEASE TAKEDA CHEMICALS INDUSTRIES, LTD. (JP) 2001-12-04 US disclosed