SCHEMBL5283760

SCHEMBL5283760

CC(C)(C#N)N=NC(C)(C)C#N.CCCCOOCCCC

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31
ADRB2 P07550 1/20 0.31
ADRB1 P08588 1/20 0.31
ADRB3 P13945 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
SCHEMBL825215 0.92 TSHR (0.32) TSHR
SCHEMBL825213 0.92 TSHR (0.32) TSHR
SCHEMBL28088725 0.81 HPGD (0.32) TSHR
SCHEMBL25206613 0.77 TSHR (0.61) TSHR
SCHEMBL28596182 0.75 TSHR (0.31) TSHR
SCHEMBL5199999 0.74
SCHEMBL122 0.74
Water SCHEMBL21518539 0.74
SCHEMBL120 0.74
Water SCHEMBL31152866 0.74

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
US-20070010623-A1 Low-refractive index layer, AR coatings having such a layer and methods for producing them ADDISON CLEAR WAVE LLC 2007-01-11 US disclosed
WO-2007006018-A1 LOW-REFRACTIVE INDEX LAYER, AR COATINGS HAVING SUCH A LAYER AND METHODS FOR PRODUCING THEM ADDISON CLEAR WAVE LLC (US) 2007-01-11 WO disclosed
CN-1338540-A Binary organo-polysiloxane/acrylate copolymer emulsion composition DOW CORNING TORAY SILICONE (JP) 2002-03-06 CN disclosed