SCHEMBL4816037

SCHEMBL4816037

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

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.38
TSHR P16473 1/20 0.36
ALDH1A1 P00352 1/20 0.33
CA1 P00915 2/20 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
SCHEMBL817685 0.80 TP53 (0.38) TDP1TSHRALDH1A1CA1
SCHEMBL18139663 0.76 TDP1 (0.33) TDP1TSHR
SCHEMBL255878 0.75
SCHEMBL3880013 0.75
SCHEMBL18141579 0.74 TDP1 (0.32) TDP1TSHRCA1
SCHEMBL18140470 0.74 CA1 (0.36) TDP1TSHRCA1
Potassium Ion SCHEMBL18140858 0.74 CA4 (0.35) TDP1TSHRCA1
Lithium Ion SCHEMBL18140703 0.74 TDP1 (0.32) TDP1TSHRCA1
SCHEMBL18141531 0.74 TDP1 (0.32) TDP1TSHRCA1
Ammonia Solution, Strong SCHEMBL18140414 0.74 TDP1 (0.32) TDP1TSHR

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
US-20080009582-A1 PROCESS FOR PRODUCING POLYMER, COATING COMPOSITION AND COATED ARTICLE ASAHI GLASS CO., LTD. (JP) 2008-01-10 US disclosed
EP-1852444-A1 METHOD FOR PRODUCING POLYMER, COATING COMPOSITION AND COATED ARTICLE Asahi Glass Company, Limited (JP) 2007-11-07 EP disclosed
US-5900462-A DEHYDRATION REACTION OF A KETONE AND ALCOHOL; HIGH DENSITY CROSSLINKING TOYO INK MANUFACTURING CO., LTD. (JP) 1999-05-04 US disclosed