SCHEMBL3363406

SCHEMBL3363406

CCCOC(O)(O)OC(=O)C(C)=C(C)C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL129272 0.74 TSHR (0.42) ALDH1A1TSHRLMNA
Ammonia Solution, Strong SCHEMBL27929081 0.73 TSHR (0.41) ALDH1A1TSHRLMNA
SCHEMBL27976281 0.71 ALDH1A1 (0.33) ALDH1A1LMNA
SCHEMBL16241502 0.69
SCHEMBL2297495 0.68 LMNA (0.38) ALDH1A1LMNA
SCHEMBL251951 0.67 ALDH1A1 (0.60) ALDH1A1TSHRLMNA
SCHEMBL8673327 0.67 KDM4E (0.31)
SCHEMBL27607317 0.67 ALDH1A1 (0.33) ALDH1A1TSHR
Ethylene SCHEMBL30712233 0.67
SCHEMBL9056348 0.65 TSHR (0.62) ALDH1A1TSHRLMNA

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-20100020274-A1 COLORANT, COLOR FILTER, LCD DEVICE, COMPOSITION AND METHOD FOR PREPARING THE SAME BOE TECHNOLOGY GROUP CO.,LTD (CN) 2010-01-28 US disclosed