SCHEMBL11118250

SCHEMBL11118250

C=C(CCO)C(=O)OC(=O)CCC(=O)OC(=O)C(=C)CCO

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
TSHR P16473 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
SCHEMBL2484913 0.92 EGLN1 (0.36)
SCHEMBL9868910 0.87
SCHEMBL11423528 0.81 ALOX15 (0.35)
SCHEMBL5479192 0.81 MGAM (0.41) ALDH1A1TSHR
SCHEMBL7513046 0.78 ALDH1A1 (0.46) ALDH1A1TSHR
SCHEMBL8824605 0.77 ALDH1A1 (0.41) ALDH1A1TSHR
SCHEMBL7750669 0.76 TSHR (0.43) ALDH1A1TSHR
SCHEMBL38652162 0.75
SCHEMBL22129789 0.74 ALDH1A1 (0.42) ALDH1A1TSHR
SCHEMBL16029326 0.73 CAMK2A (0.42)

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
JP-59038270-A None JP disclosed
JP-S5938270-A PREPARATION OF FILM-SHAPED ADHESIVE DAINIPPON PRINTING CO LTD 1984-03-02 JP disclosed