SCHEMBL9294282

SCHEMBL9294282

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

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.40
ALDH1A1 P00352 6/20 0.31
MAPT P10636 1/20 0.31
PTGS1 P23219 1/20 0.31
LMNA P02545 2/20 0.30
HSD17B10 Q99714 1/20 0.30
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL27339480 0.87 GAA (0.33) GAAALDH1A1MAPTPTGS1LMNA
SCHEMBL13156166 0.87 GAA (0.38) GAAALDH1A1MAPTPTGS1LMNA
SCHEMBL18084166 0.86 GAA (0.36) GAAALDH1A1LMNAHSD17B10TDP1
SCHEMBL10086138 0.84 GAA (0.34) GAAALDH1A1TDP1
SCHEMBL22797630 0.84 GAA (0.34) GAA
SCHEMBL19493224 0.84 KDM4E (0.44) GAAALDH1A1MAPTPTGS1
SCHEMBL14420197 0.82 GAA (0.38) GAAALDH1A1LMNAHSD17B10TDP1
SCHEMBL18011682 0.82 KDM4E (0.48) GAAALDH1A1MAPTPTGS1TSHR
SCHEMBL673097 0.81 GAA (0.35) GAAALDH1A1MAPTPTGS1TDP1
SCHEMBL20016625 0.80 ALDH1A1 (0.34) GAAALDH1A1LMNAHSD17B10

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
US-RE34640-E Polymerizing isobutylene, adding monomer to make block polymer; metal halide, initiator and electron pair doner solvent UNIVERSITY OF AKRON (US) 1994-06-14 US claimed
WO-1991011468-A1 NEW THERMOPLASTIC ELASTOMERS THE UNIVERSITY OF AKRON (US) 1991-08-08 WO claimed
US-4946899-A CARBOCATIONIC POLYMERIZATION INVOLVING HOMOPOLYMERIZATION OF ELASTOMER FOLLOWED BY COPOLYMERIZATION TO ADD GLASSY SEGMENTS; FORMING LIVING POLYMERS WITH A METAL HALIDE, PROMOTER AND SOLVENT MIXTURE THE UNIVERSITY OF AKRON (US) 1990-08-07 US claimed
CN-102356114-B Amine-terminated telechelic polymers and precursors thereto and methods for their preparation CHEVRON ORONITE CO 2014-06-25 CN disclosed