SCHEMBL27503520

SCHEMBL27503520

C=C(C)C(=O)OC(CC1CO1)CC1CO1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.56
TSHR P16473 3/20 0.36
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
THRB P10828 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
SCHEMBL4241788 0.92 ALDH1A1 (0.51) ALDH1A1TSHRTP53CYP3A4THRB
SCHEMBL9840697 0.89 ALDH1A1 (0.49) ALDH1A1TSHRTHRB
SCHEMBL28287889 0.84 ALDH1A1 (0.54) ALDH1A1TSHRTP53CYP3A4THRB
SCHEMBL970597 0.84 ALDH1A1 (0.54) ALDH1A1TSHRTP53CYP3A4THRB
SCHEMBL4566336 0.80 ALDH1A1 (0.50) ALDH1A1TSHR
SCHEMBL11651700 0.79 ALDH1A1 (0.49) ALDH1A1TSHRTHRB
SCHEMBL4952130 0.79 ALDH1A1 (0.41) ALDH1A1TSHRTHRB
SCHEMBL18889150 0.77 ALDH1A1 (0.54) ALDH1A1TSHRTP53CYP3A4
SCHEMBL27522949 0.76 ALDH1A1 (0.62) ALDH1A1TSHRTP53CYP3A4THRB
SCHEMBL27498746 0.76 ALDH1A1 (0.45) ALDH1A1TSHR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103370642-A Colored composition for color filters, and color filter TOYO INK SC HOLDINGS CO LTD 2013-10-23 CN disclosed
CN-1612042-A Colouring photosensitive resin composition SUMITOMO CHEMICAL CO (JP) 2005-05-04 CN disclosed
CN-1226815-A Method for producing amino acid acrylic monoester and composition thereof SOUTHWEST RES INST (US) 1999-08-25 CN disclosed