SCHEMBL5161744

SCHEMBL5161744

C=C(C)C(=O)OC(CCCN=C=O)N=C=O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL27842087 0.94 NOS2 (0.31) TSHR
SCHEMBL28273046 0.86
SCHEMBL5360818 0.85 TSHR (0.40) TSHR
SCHEMBL5360012 0.84 TSHR (0.42) TSHR
SCHEMBL9586384 0.82 TSHR (0.45) TSHR
SCHEMBL5362557 0.82 TSHR (0.45) TSHR
SCHEMBL5355947 0.82 TSHR (0.45) TSHR
SCHEMBL9586598 0.82 TSHR (0.45) TSHR
SCHEMBL5349827 0.82 TSHR (0.45) TSHR
SCHEMBL516924 0.81 TSHR (0.34) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0894808-B1 Modified cellulose compound and photopolymerizable resin composition containing the same TOKYO OHKA KOGYO CO LTD (JP) 2007-03-07 EP disclosed
US-6054545-A CELLULOSE MODIFIED WITH CARBOXYLATED ISOCYANATE TOKYO OHKA KOGYO CO., LTD. (JP) 2000-04-25 US disclosed
EP-0894808-A1 Modified cellulose compound and photopolymerizable resin composition containing the same TOKYO OHKA KOGYO CO., LTD. (JP) 1999-02-03 EP disclosed