Decane

Decane

SCHEMBL9501386

CCCCCCCCCC.CCCCCCCCCC.CCCCCCCCCC.CCCCCCCCCC.CCCCCCCCCC.CCCCCCCCCC.O=S(=O)(Cl)Cl

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.57
THRB P10828 1/20 0.57
FAAH O00519 2/20 0.52
ALDH1A1 P00352 2/20 0.50
CA2 P00918 10/20 0.46
CA1 P00915 8/20 0.46
CA9 Q16790 7/20 0.46
CA12 O43570 3/20 0.46
CA7 P43166 3/20 0.46
CA14 Q9ULX7 3/20 0.46
CA3 P07451 2/20 0.46
CA4 P22748 2/20 0.46
CA6 P23280 2/20 0.46
CA5A P35218 2/20 0.46
CA5B Q9Y2D0 2/20 0.46
PPARA Q07869 2/20 0.46

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
Heptane SCHEMBL5040464 1.00 TSHR (0.57) TSHRTHRBFAAHALDH1A1CA2
Pentadecane SCHEMBL28155224 1.00 TSHR (0.57) TSHRTHRBFAAHALDH1A1CA2
Nonane SCHEMBL6130063 1.00 TSHR (0.57) TSHRTHRBFAAHALDH1A1CA2
Tridecane SCHEMBL11411803 1.00 TSHR (0.57) TSHRTHRBFAAHALDH1A1CA2
Decane SCHEMBL11411799 1.00 TSHR (0.57) TSHRTHRBFAAHALDH1A1CA2
Dodecane SCHEMBL5440620 1.00 TSHR (0.57) TSHRTHRBFAAHALDH1A1CA2
Hexadecane SCHEMBL2406023 1.00 TSHR (0.57) TSHRTHRBFAAHALDH1A1CA2
Decane SCHEMBL5040348 1.00 TSHR (0.57) TSHRTHRBFAAHALDH1A1CA2
Octane SCHEMBL569265 1.00 TSHR (0.57) TSHRTHRBFAAHALDH1A1CA2
Hexane SCHEMBL1937959 0.96 TSHR (0.50) TSHRTHRBFAAHALDH1A1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012134735-A1 PEROXIDE-FREE METHACRYLATE STRUCTURAL ADHESIVES HUNTSMAN ADVANCED MATERIALS AMERICAS LLC (US) 2012-10-04 WO disclosed
EP-0278642-B1 STRUCTURAL ADHESIVE COMPOSITIONS LORD CORPORATION (US) 1993-08-11 EP disclosed
EP-0540729-A1 BLOCKED FILTER DYES FOR PHOTOGRAPHIC MATERIAL AND PROCESS EASTMAN KODAK COMPANY (US) 1993-05-12 EP disclosed
WO-1992021064-A1 BLOCKED FILTER DYES FOR PHOTOGRAPHIC MATERIAL AND PROCESS EASTMAN KODAK COMPANY (US) 1992-11-26 WO disclosed
US-4857131-A Two-part adhesive for bonding plastics and metals LORD CORPORATION (US) 1989-08-15 US disclosed
US-4855001-A Structural adhesive formulations and bonding method employing same LORD CORPORATION (US) 1989-08-08 US disclosed
EP-0278642-A2 Structural adhesive compositions LORD CORPORATION (US) 1988-08-17 EP disclosed
EP-0158462-B1 AMBIENT TEMPERATURE CURABLE STRUCTURE ADHESIVE COMPOSITIONS AND A METHOD OF ADHERING ONE METAL SURFACE TO ANOTHER USING THE SAME LORD CORPORATION (US) 1988-07-13 EP disclosed
US-4703089-A HEAT CURABLE ADDITION POLYMERS, POLYURETHANES; BRONSTED ACID CATALYSTS, REDUCIBLE METAL COMPONENTS, SULFONYL HALIDES; BLENDS FOR METAL BONDING LORD CORPORATION, A CORP. OF PA 1987-10-27 US disclosed
EP-0158462-A2 Ambient temperature curable structure adhesive compositions and a method of adhering one metal surface to another using the same LORD CORPORATION (US) 1985-10-16 EP disclosed