SCHEMBL4231827

SCHEMBL4231827

C=C(C)C(=O)OC(CC[SiH](OCCCC)OCCCC)OC(=O)C(=C)C

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.41
ALDH1A1 P00352 1/20 0.33
THRB P10828 1/20 0.33
POLB P06746 1/20 0.31
APEX1 P27695 1/20 0.31
HTT P42858 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
HPGD P15428 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
SCHEMBL4231640 0.91 TSHR (0.37) TSHRALDH1A1THRB
SCHEMBL4222599 0.84 THRB (0.36) TSHRALDH1A1THRB
SCHEMBL4236579 0.79 TSHR (0.47) TSHRALDH1A1THRBHPGD
SCHEMBL612282 0.79 TSHR (0.48) TSHRALDH1A1THRB
SCHEMBL5699021 0.78 TSHR (0.59) TSHRALDH1A1THRBPOLBAPEX1
SCHEMBL4222812 0.78 ALDH1A1 (0.39) TSHRALDH1A1THRB
SCHEMBL28905697 0.78 TSHR (0.35) TSHR
SCHEMBL60550 0.77 TSHR (0.52) TSHRALDH1A1
SCHEMBL144127 0.77 TSHR (0.62) TSHRALDH1A1THRBPOLBAPEX1
SCHEMBL22572596 0.76 TSHR (0.55) TSHR

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-20090263631-A1 FILM FORMING COMPOSITION FOR NANOIMPRINTING AND METHOD FOR PATTERN FORMATION TOKYO OHKA KOGYO CO., LTD. (JP) 2009-10-22 US disclosed