SCHEMBL5165796

SCHEMBL5165796

CC(CO)(CO)C(=O)[O-].CC(CO)(CO)C(=O)[O-].[Ni+2]

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
HIF1A Q16665 1/20 0.32
CA2 P00918 1/20 0.32
CA1 P00915 2/20 0.32
CA4 P22748 1/20 0.31

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
SCHEMBL5144808 0.94 CYP2D6 (0.32) CYP2D6TSHRCYP2C19HIF1ACA2
Potassium Ion SCHEMBL2701663 0.94 CA4 (0.35) CYP2D6TSHRCYP2C19HIF1ACA2
Zinc Ion SCHEMBL5144410 0.94 CYP2D6 (0.32) CYP2D6TSHRCYP2C19HIF1ACA2
SCHEMBL5144685 0.94 CYP2D6 (0.32) CYP2D6TSHRCYP2C19HIF1ACA2
Lithium Ion SCHEMBL5144788 0.94 CYP2D6 (0.32) CYP2D6TSHRCYP2C19HIF1ACA2
SCHEMBL2031599 0.94 CA2 (0.38) CYP2D6TSHRCYP2C19HIF1ACA2
SCHEMBL5080076 0.94 CYP2D6 (0.32) CYP2D6TSHRCYP2C19HIF1ACA2
SCHEMBL5080079 0.94 CYP2D6 (0.32) CYP2D6TSHRCYP2C19HIF1ACA2
SCHEMBL5142314 0.94 CYP2D6 (0.32) CYP2D6TSHRCYP2C19HIF1ACA2
SCHEMBL217476 0.94 CYP2D6 (0.32) CYP2D6TSHRCYP2C19HIF1ACA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1551893-A4 POLYURETHANE IONOMERS AND METHODS FOR THEIR PREPARATION AND FORMATION RISEN WILLIAM M JR (US) 2007-05-09 EP disclosed
US-20060030666-A1 Polyurethane ionomers and methods for their preparation and formation RISEN WILLIAM JR 2006-02-09 US disclosed
US-6958380-B2 Polyurethane ionomers and methods for their preparation and formation CALLAWAY GOLF COMPANY (US) 2005-10-25 US disclosed
US-6949604-B2 Polyurethane ionomer blends and methods for their preparation and formation BROWN UNIVERSITY (US) 2005-09-27 US disclosed
EP-1551893-A1 POLYURETHANE IONOMERS AND METHODS FOR THEIR PREPARATION AND FORMATION Risen, William M Jr. (US) 2005-07-13 EP disclosed
WO-2004110604-A2 POLYURETHANE IONOMER BLENDS AND METHODS FOR THEIR PREPARATION AND FORMATION RISEN WILLIAM (US) 2004-12-23 WO disclosed
WO-2004003047-A1 POLYURETHANE IONOMERS AND METHODS FOR THEIR PREPARATION AND FORMATION RISEN WILLIAM (US) 2004-01-08 WO disclosed
US-20030199662-A1 Polyurethane ionomer blends and methods for their preparation and formation RISEN WILLIAM M (US) 2003-10-23 US disclosed
US-20030109648-A1 Polyurethane ionomers and methods for their preparation and formation RISEN WILLIAM M (US) 2003-06-12 US disclosed