SCHEMBL1072148

SCHEMBL1072148

C=CCN1CC(C)OC(C)C1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.44
EBP Q15125 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.41
PDK1 Q15118 1/20 0.38
KDM4E B2RXH2 5/20 0.37
HTT P42858 1/20 0.37
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
TDP1 Q9NUW8 3/20 0.35
CYP2A13 Q16696 1/20 0.35
ALDH1A1 P00352 3/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPT P10636 1/20 0.33
OPRM1 P35372 1/20 0.32
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
SCHEMBL10815846 1.00 SIGMAR1 (0.44) SIGMAR1EBPSMN1; SMN2PDK1KDM4E
SCHEMBL24693237 0.78
SCHEMBL4000984 0.77 SIGMAR1 (0.44) SIGMAR1EBPSMN1; SMN2PDK1KDM4E
SCHEMBL4745932 0.77 SIGMAR1 (0.44) SIGMAR1EBPSMN1; SMN2PDK1KDM4E
SCHEMBL16764751 0.77 SIGMAR1 (0.44) SIGMAR1EBPSMN1; SMN2PDK1KDM4E
SCHEMBL11951506 0.77 DRD3 (0.43) SMN1; SMN2KDM4EHTTLMNAGAA
SCHEMBL10838040 0.76
Bromide SCHEMBL28935807 0.74 DRD3 (0.43) SIGMAR1PDK1KDM4ELMNA
SCHEMBL1784863 0.73 SIGMAR1 (0.48) SIGMAR1EBPSMN1; SMN2PDK1KDM4E
SCHEMBL9449486 0.73 SIGMAR1 (0.48) SIGMAR1EBPSMN1; SMN2PDK1KDM4E

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 89 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1889029-A1 METHOD FOR DETERMINING RESIDUES IN PLASTICS BASF AKTIENGESELLSCHAFT (DE) 2008-02-20 EP claimed
WO-2006125647-A1 METHOD FOR DETERMINING RESIDUES IN PLASTICS BASF AKTIENGESELLSCHAFT (DE) 2006-11-30 WO claimed
US-20050234070-A1 Agents for preserving technical materials against insects TSUBOI SHINICHI 2005-10-20 US claimed
EP-0986304-B1 FUNGICIDAL MIXTURE BASF AG (DE) 2002-07-24 EP claimed
US-6369090-B1 Fungicidal mixture BASF AKTIENGESELLSCHAFT (DE) 2002-04-09 US claimed
US-6303599-B1 TO TREAT HARMFUL FUNGI, THEIR HABITAT, OR THE PLANTS, SEEDS, SOILS, AREAS, MATERIALS OR SPACES TO BE KEPT FREE FROM FUNGI BASF AKTIENGESELLSCHAFT (DE) 2001-10-16 US claimed
EP-0313353-B1 MORPHOLINYL SILANES AND USE FOR CONTROL OF PLANT DISEASES CAUSED BY FUNGI DOWELANCO (US) 1992-06-17 EP claimed
EP-0207431-B1 N-ALKYL-2,6-DIMETHYLMORPHOLINIO-CARBOXYLIC-ACID AMIDE SALTS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS FUNGICIDES Institut für Pflanzenschutzforschung Kleinmachnow der A.d.L. der DDR (DD) 1990-08-16 EP claimed
WO-1989003640-A1 MORPHOLINYL SILANES AND USE FOR CONTROL OF PLANT DISEASES CAUSED BY FUNGI THE DOW CHEMICAL COMPANY (US) 1989-05-05 WO claimed
EP-0313353-A1 Morpholinyl silanes and use for control of plant diseases caused by fungi DOWELANCO (US) 1989-04-26 EP claimed
EP-0209763-A1 Salts of morpholiniocarboxylic esters and morpholinioalkyl-phenylethers, processes for their preparation, and their use as fungicides Institut für Pflanzenschutzforschung Kleinmachnow der A.d.L. der DDR (DD) 1987-01-28 EP claimed
EP-0207431-A1 N-alkyl-2,6-dimethylmorpholinio-carboxylic-acid amide salts, process for their preparation and their use as fungicides Institut für Pflanzenschutzforschung Kleinmachnow der A.d.L. der DDR (DD) 1987-01-07 EP claimed
US-9028856-B2 Synergistic pesticide compositions BAYER CROPSCIENCE LP (US) 2015-05-12 US disclosed
EP-2698061-A1 Synergistic pesticide compositions Bayer Cropscience LP (US) 2014-02-19 EP disclosed
US-20130217574-A1 SYNERGISTIC PESTICIDE COMPOSITIONS BAYER CROPSCIENCE LP (US) 2013-08-22 US disclosed
US-20130183390-A1 SYNERGISTIC PESTICIDE COMPOSITIONS BAYER CROPSCIENCE LP (US) 2013-07-18 US disclosed
EP-0262307-A2 Process for preparing hydroxymorpholines and morpholines TEXACO DEVELOPMENT CORPORATION (US) 1988-04-06 EP disclosed
US-4670557-A Process for preparing hydroxymorpholines TEXACO INC. (US) 1987-06-02 US disclosed
EP-0209763-A1 Salts of morpholiniocarboxylic esters and morpholinioalkyl-phenylethers, processes for their preparation, and their use as fungicides Institut für Pflanzenschutzforschung Kleinmachnow der A.d.L. der DDR (DD) 1987-01-28 EP disclosed
EP-0207431-A1 N-alkyl-2,6-dimethylmorpholinio-carboxylic-acid amide salts, process for their preparation and their use as fungicides Institut für Pflanzenschutzforschung Kleinmachnow der A.d.L. der DDR (DD) 1987-01-07 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 (3 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-20050234070-A1 Agents for preserving technical materials against insects TREH, GPX4, GPX1 SIGMAR1 4449/4885EBP 1761/4885SMN1; SMN2 1224/4885
US-20130217574-A1 SYNERGISTIC PESTICIDE COMPOSITIONS DDT, ACHE, CHRM3 SIGMAR1 3426/4885EBP 916/4885SMN1; SMN2 3239/4885
US-20130183390-A1 SYNERGISTIC PESTICIDE COMPOSITIONS DDT, ACHE, CHRM3 SIGMAR1 3426/4885EBP 916/4885SMN1; SMN2 3239/4885

“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.