SCHEMBL4885676

SCHEMBL4885676

C=CC(=O)C(C)n1c(=O)n(C(C)C(=O)C=C)c(=O)n(C(C)C(=O)C=C)c1=O

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
ALDH1A1 P00352 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
SCHEMBL82544 0.71
SCHEMBL20819475 0.70
SCHEMBL476933 0.68 TSHR (0.39) TSHR
SCHEMBL262036 0.68 TDP1 (0.31) TSHR
SCHEMBL220078 0.66
SCHEMBL451449 0.65 CYP3A4 (0.31)
SCHEMBL4233335 0.64
SCHEMBL27553125 0.64
SCHEMBL8536846 0.64
SCHEMBL28371729 0.64

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080281015-A1 Photocurable Composition and Optical Part FUTAMI SATOCHI 2008-11-13 US disclosed
US-20080039546-A1 Photocurable Composition and Optical Part JSR CORPORATION (JP) 2008-02-14 US disclosed
EP-1692199-A1 PHOTOCURABLE COMPOSITION AND OPTICAL PART DSM IP Assets B.V. (NL) 2006-08-23 EP disclosed
US-20050256219-A1 Photocurable resin composition and optical component JSR CORPORATION (JP) 2005-11-17 US disclosed
WO-2005095527-A1 PHOTOCURABLE COMPOSITION AND OPTICAL PART JSR CORPORATION (JP) 2005-10-13 WO disclosed
WO-2005054317-A1 PHOTOCURABLE COMPOSITION AND OPTICAL PART DSM IP ASSETS B.V. (NL) 2005-06-16 WO disclosed
US-6440519-B1 FAST CURE SPEED AND SUPERIOR ADHESION UNDER HIGH TEMPERATURE-HIGH HUMIDITY CONDITIONS AND METAL CORROSION PROPERTIES DSM N.V. (NL) 2002-08-27 US disclosed