SCHEMBL5857717

SCHEMBL5857717

CC(C)CCO[Ti](OCCC(C)C)(OCCC(C)C)OC(C)C

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 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
SCHEMBL6230379 0.84 ALDH1A1 (0.42) ALDH1A1CA12CA1CA2CA9
SCHEMBL4694513 0.78
SCHEMBL2379584 0.73 ADRB2 (0.35) ALDH1A1
SCHEMBL7548413 0.71 DNM1 (0.33) CA12CA1CA2CA9
SCHEMBL8815842 0.70 LMNA (0.32)
SCHEMBL10602562 0.70 HSD17B10 (0.31)
SCHEMBL11306849 0.70 DNM1 (0.36) CA1CA2CA9
SCHEMBL8146511 0.70 DNM1 (0.36) CA1CA2CA9
SCHEMBL6741636 0.70 DNM1 (0.36) CA1CA2CA9
SCHEMBL7709107 0.69 ALDH1A1 (0.31) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7098272-B2 Method for producing hydroxyl group-containing polymer particles FUJI XEROX CO., LTD. (JP) 2006-08-29 US disclosed
US-7094860-B2 Maleimide group-containing polymer particles and method of producing the same FUJI XEROX CO., LTD. (JP) 2006-08-22 US disclosed
US-20050014924-A1 Maleimide group-containing polymer particles and method of producing the same FUJI XEROX CO., LTD. (JP) 2005-01-20 US disclosed
US-20050009996-A1 Method for producing hydroxyl group-containing polymer particles FUJI XEROX CO., LTD. (JP) 2005-01-13 US disclosed