SCHEMBL6450455

SCHEMBL6450455

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

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TET2 Q6N021 1/20 0.42
TDP1 Q9NUW8 1/20 0.38
FFAR3 O14843 1/20 0.32
HMGCR P04035 1/20 0.31
CHRM1 P11229 1/20 0.31
TBXA2R P21731 1/20 0.31
ADRA1A P35348 1/20 0.31
CYP2D6 P10635 1/20 0.30
TSHR P16473 1/20 0.30
CYP2C19 P33261 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
SCHEMBL6519752 0.79 TET2 (0.39) TET2TDP1CYP2D6TSHRCYP2C19
SCHEMBL6449731 0.77 TET2 (0.40) TET2HMGCRCHRM1TBXA2RADRA1A
SCHEMBL6520714 0.77 TET2 (0.36) TET2TDP1FFAR3
SCHEMBL9737294 0.77 TDP1 (0.45) TET2TDP1FFAR3HMGCRCHRM1
SCHEMBL1963590 0.77 TET2 (0.38) TET2FFAR3HMGCRCHRM1TBXA2R
SCHEMBL2138939 0.77 TET2 (0.38) TET2FFAR3HMGCRCHRM1TBXA2R
SCHEMBL6520592 0.74 TET2 (0.34) TET2TDP1
Hydrochloric Acid SCHEMBL28222918 0.73 TET2 (0.35) TET2
SCHEMBL6450320 0.73 TET2 (0.35) TET2TDP1FFAR3
SCHEMBL9688090 0.70 TDP1 (0.43) TDP1FFAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6916543-B2 Copolymer, photoresist compositions thereof and deep UV bilayer system thereof ARCH SPECIALTY CHEMICALS, INC. (US) 2005-07-12 US disclosed
US-20040137362-A1 Novel copolymer, photoresist compositions thereof and deep UV bilayer system thereof ARCH SPECIALTY CHEMICALS, INC. 2004-07-15 US disclosed