SCHEMBL6701258

SCHEMBL6701258

CC1(C)CC(CCC2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
GAA P10253 3/20 0.39
RECQL P46063 1/20 0.35
LMNA P02545 2/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 3/20 0.32
NPSR1 Q6W5P4 1/20 0.32
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
ALOX15 P16050 1/20 0.31
ALOX12 P18054 1/20 0.31
RAD52 P43351 1/20 0.31
GFER P55789 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL16749055 0.92 GAA (0.43) TSHRGAARECQLLMNAKDM4E
SCHEMBL818726 0.87 TSHR (0.36) TSHRGAARECQLLMNAKDM4E
SCHEMBL10430410 0.87 TSHR (0.36) TSHRGAARECQLLMNAKDM4E
SCHEMBL10621109 0.87 TSHR (0.36) TSHRGAARECQLLMNAKDM4E
SCHEMBL474276 0.85 TSHR (0.39) TSHRGAARECQLLMNAKDM4E
SCHEMBL3961646 0.85 TSHR (0.36) TSHRGAARECQLLMNAKDM4E
SCHEMBL3125698 0.85 TSHR (0.36) TSHRGAARECQLLMNAKDM4E
Ammonia Solution, Strong SCHEMBL10430910 0.85 TSHR (0.36) TSHRGAARECQLLMNAKDM4E
SCHEMBL10952050 0.85 TSHR (0.36) TSHRGAARECQLLMNAKDM4E
SCHEMBL4727634 0.83 CYP1A2 (0.43) TSHRGAARECQLLMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0151042-B1 POLYACETAL RESIN COMPOSITION AND MOULDED PRODUCTS THEREOF POLYPLASTICS CO. LTD. (JP) 1988-08-17 EP claimed
US-20040197460-A1 Fatty acid esters composition of a polyglycerine, a process for the preparation thereof, a process for the preparation of a highly-purified fatty acid esters composition of a polyglycerine, a highly-purified fatty acid esters composition of a polyglycerine, an additive for food-stuffs, a resin composition, and a composition for cosmetic or detergents ENDO TOSHIO (JP) 2004-10-07 US disclosed
US-6693150-B1 THERMOPLASTIC RESIN AND GLYCERIDE WITH HIGH CONCENTRATION OF MONOESTER AND VERY LOW OXIRANE CONTENT DAICEL CHEMICAL INDUSTRIES LTD. (JP) 2004-02-17 US disclosed
US-6339165-B1 AS ADDITIVES FOR FOOD-STUFFS, THERMOPLASTIC RESINS, COSMETICS OR DETERGENTS DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2002-01-15 US disclosed
US-6278008-B1 AS ADDITIVES FOR FOOD-STUFFS, THERMOPLASTIC RESINS, COSMETICS OR DETERGENTS DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2001-08-21 US disclosed
EP-0758641-B1 A fatty acid esters composition of a polyglycerine, a process for the preparation thereof, a process for the preparation of a highly-purified fatty acid esters composition of a polyglycerine, a highly-purified fatty acid esters composition of a polyglycerine, an additive for food-stuffs, a resin composition, and a composition for cosmetics or detergents DAICEL CHEM (JP) 2000-08-30 EP disclosed
EP-0758641-A1 A fatty acid esters composition of a polyglycerine, a process for the preparation thereof, a process for the preparation of a highly-purified fatty esters composition of a polyglycerine, a highly-purified fatty esters composition of a polyglycerine, an additive for food-stuffs, a resin composition, and a composition for cosmetics or detergents DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1997-02-19 EP disclosed
EP-0151042-B1 POLYACETAL RESIN COMPOSITION AND MOULDED PRODUCTS THEREOF POLYPLASTICS CO. LTD. (JP) 1988-08-17 EP disclosed
EP-0151042-A2 Polyacetal resin composition and moulded products thereof POLYPLASTICS CO. LTD. (JP) 1985-08-07 EP disclosed
US-4335242-A Triazine derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1982-06-15 US disclosed
EP-0024338-B1 TRIAZINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS STABILISING AGENTS FOR SYNTHETIC POLYMERS HOECHST AKTIENGESELLSCHAFT (DE) 1982-04-28 EP disclosed
EP-0024338-A1 Triazine derivatives, their preparation and their use as stabilising agents for synthetic polymers HOECHST AKTIENGESELLSCHAFT (DE) 1981-03-04 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040197460-A1 Fatty acid esters composition of a polyglycerine, a process for the preparation thereof, a process for the preparation of a highly-purified fatty acid esters composition of a polyglycerine, a highly-purified fatty acid esters composition of a polyglycerine, an additive for food-stuffs, a resin composition, and a composition for cosmetic or detergents DGAT2, FASN, SQLE TSHR 2946/4885GAA 209/4885RECQL 2681/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.