SCHEMBL27238501

SCHEMBL27238501

C=C(C)C(=O)OCCOC(=O)C(CC)CCCCP.[H+]

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.45
TSHR P16473 3/20 0.44
CA2 P00918 3/20 0.38
CA1 P00915 2/20 0.38
POLB P06746 1/20 0.33
APEX1 P27695 1/20 0.33
HTT P42858 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MAPK1 P28482 1/20 0.31
CPB2 Q96IY4 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL27075789 0.84 THRB (0.44) THRBTSHRCA2CA1POLB
Phosphoric Acid SCHEMBL139116 0.80 TSHR (0.51) THRBTSHRCA2CA1MAPK1
SCHEMBL27944204 0.80 TSHR (0.44) THRBTSHRCA2CA1POLB
SCHEMBL6331921 0.80 TSHR (0.44) THRBTSHRCA2CA1POLB
SCHEMBL95647 0.80 TSHR (0.44) THRBTSHRCA2CA1POLB
SCHEMBL28298721 0.74 TSHR (0.69) THRBTSHRPOLBAPEX1HTT
SCHEMBL5965688 0.74 TSHR (0.62) THRBTSHRCA2CA1POLB
Bromide SCHEMBL28166719 0.73 TSHR (0.67) THRBTSHRPOLBAPEX1HTT
Ethylene SCHEMBL28284661 0.73 TSHR (0.67) THRBTSHRPOLBAPEX1HTT
Ethylene SCHEMBL8346683 0.71 CA2 (0.66) TSHRCA2CA1TDP1MAPK1

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-20240189195-A1 DENTAL POLYMERIZABLE COMPOSITION GC CORPORATION (JP) 2024-06-13 US disclosed