SCHEMBL9045321

SCHEMBL9045321

CCC(CC)(CC)C(=O)OOC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34

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
SCHEMBL17512944 0.86 CYP4F2 (0.32) TSHRTDP1ALDH1A1HSD17B10CYP4F2
SCHEMBL14196625 0.81 TSHR (0.36) TSHRTDP1ALDH1A1HSD17B10CYP4F2
SCHEMBL27570680 0.76 ALDH1A1 (0.33) TSHRTDP1ALDH1A1HSD17B10
SCHEMBL3059758 0.74 HSD17B10 (0.33) TSHRTDP1ALDH1A1HSD17B10
SCHEMBL15165 0.74 TSHR (0.41) TSHRTDP1ALDH1A1HSD17B10
SCHEMBL6690279 0.73 CYP4F2 (0.41) CYP4F2CYP4A11
SCHEMBL29291915 0.73 CYP4F2 (0.38) CYP4F2CYP4A11
SCHEMBL4679417 0.72 TSHR (0.40) TSHRTDP1ALDH1A1HSD17B10
Methyl Alcohol SCHEMBL28449343 0.72 TSHR (0.40) TSHRTDP1ALDH1A1HSD17B10
Ammonia Solution, Strong SCHEMBL28163619 0.71 CYP4F2 (0.38) ALDH1A1CYP4F2CYP4A11

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
EP-0522376-B1 Process for the manufacture of polyalkylmethacrylate-macromonomers ROEHM GMBH (DE) 1996-03-13 EP disclosed
US-5254632-A Method of manufacturing polyalkyl methacrylate macromonomers, and use of same in the manufacture of comb polymers ROHM GMBH CHEMISCHE FABRIK (DE) 1993-10-19 US disclosed
EP-0522376-A1 Process for the manufacture of polyalkylmethacrylate-macromonomers RÖHM GMBH (DE) 1993-01-13 EP disclosed