SCHEMBL3677798

SCHEMBL3677798

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

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 1/20 0.31
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
HSD17B10 Q99714 1/20 0.30
SERPINE1 P05121 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
SCHEMBL372921 0.84 ALDH1A1 (0.31) ALDH1A1SERPINE1
SCHEMBL651493 0.81 CYP2C19 (0.31) GLO1
SCHEMBL9236598 0.79
SCHEMBL9236604 0.79
SCHEMBL8850612 0.79 LMNA (0.34) LMNAHSD17B10
SCHEMBL3164849 0.79
SCHEMBL6716655 0.78 THRB (0.47) ALDH1A1LMNAHSD17B10SERPINE1
SCHEMBL8583775 0.77 ALDH1A1 (0.40) ALDH1A1
SCHEMBL2764469 0.77 ALDH1A1 (0.40) ALDH1A1
SCHEMBL8583776 0.77 ALDH1A1 (0.40) ALDH1A1

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-8329065-B2 Carbon nanotube-containing composition, composite, and methods for producing them MITSUBISHI RAYON CO., LTD. (JP) 2012-12-11 US disclosed
US-20100065788-A1 CARBON NANOTUBE-CONTAINING COMPOSITION, COMPOSITE, AND METHODS FOR PRODUCING THEM MITSUBISHI RAYON CO., LTD. (JP) 2010-03-18 US disclosed