SCHEMBL1552364

SCHEMBL1552364

[CH2]C(O)COC(OCC1CO1)C(C)O

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
TSHR P16473 2/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL14836264 0.87 ALDH1A1 (0.41) ALDH1A1TSHRMAPK1SMN1; SMN2
SCHEMBL7246672 0.75 ALDH1A1 (0.37) ALDH1A1
SCHEMBL671633 0.74 TSHR (0.43) ALDH1A1TSHR
SCHEMBL29190934 0.74 ALDH1A1 (0.40) ALDH1A1TSHRMAPK1SMN1; SMN2
SCHEMBL28575322 0.74 ALDH1A1 (0.40) ALDH1A1TSHRMAPK1SMN1; SMN2
SCHEMBL17493419 0.74
SCHEMBL1261540 0.73
SCHEMBL1892342 0.73
SCHEMBL19155242 0.73
SCHEMBL9792651 0.73 ALDH1A1 (0.43) ALDH1A1TSHRMAPK1SMN1; SMN2

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
EP-2055698-B1 CHROMENE COMPOUND TOKUYAMA CORP (JP) 2011-04-27 EP disclosed
EP-2055698-A1 CHROMENE COMPOUND Tokuyama Corporation (JP) 2009-05-06 EP disclosed