SCHEMBL29212840

SCHEMBL29212840

CCOP(=O)(OCCN)OCCN

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.65
CYP3A4 P08684 2/20 0.48
ALDH1A1 P00352 1/20 0.40
TP53 P04637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
PPARD Q03181 2/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 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
SCHEMBL6014558 1.00 TSHR (0.65) TSHRCYP3A4ALDH1A1TP53TDP1
Triethyl Phosphate SCHEMBL31533519 0.92 TSHR (0.77) TSHRCYP3A4ALDH1A1TP53TDP1
SCHEMBL555003 0.87 ALDH1A1 (0.50) TSHRCYP3A4ALDH1A1
SCHEMBL5462392 0.86 TSHR (0.59) TSHRCYP3A4ALDH1A1TP53TDP1
SCHEMBL30902591 0.85 CYP3A4 (0.54) TSHRCYP3A4ALDH1A1MEN1KMT2A
SCHEMBL16187636 0.84 TSHR (0.56) TSHRCYP3A4ALDH1A1TP53TDP1
SCHEMBL8962338 0.84 TSHR (0.81) TSHRCYP3A4ALDH1A1TP53TDP1
SCHEMBL22288214 0.84 ALDH1A1 (0.48) TSHRCYP3A4ALDH1A1
Methacrylic Acid SCHEMBL28569654 0.83 TSHR (0.45) TSHRCYP3A4CA12CA1CA2
SCHEMBL6953430 0.82 TSHR (0.54) TSHRCYP3A4ALDH1A1MEN1KMT2A

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
CN-118006118-B Halogen-free flame-retardant biaxially oriented nylon film and preparation method thereof 昆山运城塑业有限公司 2024-09-13 CN disclosed
CN-118006118-A Halogen-free flame-retardant biaxially oriented nylon film and preparation method thereof 昆山运城塑业有限公司 2024-05-10 CN disclosed