SCHEMBL8433764

SCHEMBL8433764

C=C(C)C(=O)N(C(=O)O)C(=O)C(=C)C

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 1/20 0.33
FFAR3 O14843 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33

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
SCHEMBL8642402 0.94 TDP1 (0.38) TDP1ALDH1A1FFAR3LCKFYN
SCHEMBL309028 0.84 TDP1 (0.44) TDP1ALDH1A1FFAR3LCKFYN
SCHEMBL372647 0.79 TDP1 (0.40) TDP1ALDH1A1
SCHEMBL8362093 0.79 TDP1 (0.40) TDP1ALDH1A1
SCHEMBL3846286 0.75 FFAR3 (0.38) TDP1ALDH1A1FFAR3LCKFYN
SCHEMBL7637758 0.74 TDP1 (0.50) TDP1ALDH1A1
SCHEMBL8743149 0.74 TDP1 (0.36) TDP1ALDH1A1FFAR3LCKFYN
SCHEMBL8722237 0.72 TDP1 (0.35) TDP1ALDH1A1FFAR3LCKFYN
SCHEMBL8977421 0.70 TDP1 (0.33) TDP1
SCHEMBL7203144 0.70 ALDH1A1 (0.41) TDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-10139752-A None JP disclosed
US-5892100-A DEHYDROHALOGENATION BY REACTION OF UNSATURATED ACID HALIDES WITH CARBAMATE IN THE PRESENCE OF HINDERED AMINE NIPPON PAINT CO., LTD. (JP) 1999-04-06 US disclosed
JP-H10139752-A PRODUCTION OF N-ACYLCARBAMIC ACID ESTER NIPPON PAINT CO LTD 1998-05-26 JP disclosed
EP-0827953-A2 Method for producing N-acyl carbamate Nippon Paint Co., Ltd. (JP) 1998-03-11 EP disclosed