SCHEMBL17522101

SCHEMBL17522101

C=CC(=O)N(CCOC(=O)C(=C)C)CCN(CCOC(=O)C(=C)C)C(=O)C=C

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.44
TSHR P16473 4/20 0.43
ZDHHC20 Q5W0Z9 2/20 0.38
ALDH1A1 P00352 2/20 0.35
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ZDHHC2 Q9UIJ5 1/20 0.33
HPGD P15428 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL1628726 0.98 THRB (0.46) THRBTSHRZDHHC20ALDH1A1POLB
SCHEMBL17522087 0.90 THRB (0.46) THRBTSHRZDHHC20ALDH1A1POLB
SCHEMBL22215990 0.90 THRB (0.37) THRBTSHRZDHHC20
SCHEMBL22215970 0.88 THRB (0.38) THRBTSHRZDHHC20ALDH1A1POLB
SCHEMBL17522107 0.85 TSHR (0.39) THRBTSHRZDHHC20ALDH1A1POLB
SCHEMBL20081689 0.84 ZDHHC20 (0.38) THRBTSHRZDHHC20ALDH1A1ZDHHC2
SCHEMBL22215965 0.83 ZDHHC20 (0.40) THRBTSHRZDHHC20ALDH1A1POLB
SCHEMBL17522082 0.83 THRB (0.44) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL22215976 0.82 THRB (0.50) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL17773282 0.82 THRB (0.50) THRBTSHRALDH1A1POLBAPEX1

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
US-20200223966-A1 CURABLE COMPOSITION, FILM, CURED PRODUCT, AND MEDICAL MEMBER FUJIFILM CORPORATION (JP) 2020-07-16 US disclosed
US-9267043-B2 Polymerizable compound, ink cartridge containing ink including the polymerizable compound, inkjet recording apparatus using the ink cartridge, and print formed by ink including the polymerizable compound RICOH COMPANY, LTD. (JP) 2016-02-23 US disclosed
US-9267043-B2 Polymerizable compound, ink cartridge containing ink including the polymerizable compound, inkjet recording apparatus using the ink cartridge, and print formed by ink including the polymerizable compound RICOH COMPANY, LTD. (JP) 2016-02-23 US disclosed