SCHEMBL9011086

SCHEMBL9011086

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

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.40
CRBN Q96SW2 1/20 0.32
CA2 P00918 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ECE1 P42892 1/20 0.30
LDHA P00338 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MAPK1 P28482 1/20 0.30
HIF1A Q16665 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
SCHEMBL21845015 0.82 KDM4E (0.48) ALDH1A1KDM4EMAPK1HIF1A
SCHEMBL8140590 0.82
SCHEMBL13205118 0.80 PLA2G2A (0.36) TDP1ALDH1A1KDM4EMAPK1HIF1A
SCHEMBL9473136 0.77 KEAP1 (0.37) ALDH1A1
SCHEMBL10018100 0.77 EPHX1 (0.44) ALDH1A1
SCHEMBL16392763 0.77
SCHEMBL16114457 0.77 ALDH1A1 (0.36) TDP1ALDH1A1
SCHEMBL6055131 0.76 TDP1 (0.32) TDP1CA2
SCHEMBL472252 0.76 TDP1 (0.42) TDP1CRBNALDH1A1KDM4EMAPK1
SCHEMBL6863950 0.75 ZDHHC20 (0.48) TDP1ALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109153876-B Aqueous polymer dispersion and aqueous coating composition comprising the same 陶氏环球技术有限责任公司 2021-06-25 CN disclosed
US-5518585-A Neutral sizing agent for base paper stuff with the use of cationic plastics dispersions HOECHST AKTIENGESELLSCHAFT (DE) 1996-05-21 US disclosed
US-5256731-A Fluoropolymer or copolymers; protective coatings HOECHST AG (DE) 1993-10-26 US disclosed
US-5126411-A For coatings, films, fibers, adhesives HOECHST AG (DE) 1992-06-30 US disclosed
US-5089570-A Protective colloids HOECHST AKTIENGESELLSCHAFT (DE) 1992-02-18 US disclosed