SCHEMBL31017

SCHEMBL31017

CC(C)(C)OC(=O)N1CCC(c2nc(C=NO)cs2)CC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.48
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44
THRB P10828 1/20 0.44
EED O75530 1/20 0.39
RBBP4 Q09028 1/20 0.39
SUZ12 Q15022 1/20 0.39
EZH2 Q15910 1/20 0.39
AEBP2 Q6ZN18 1/20 0.39
PTPN2 P17706 1/20 0.39
PTPN1 P18031 1/20 0.39
PTPN6 P29350 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL3710634 1.00 GPR119 (0.48) GPR119KDM4EMAPTTHRBEED
SCHEMBL31016 1.00 GPR119 (0.48) GPR119KDM4EMAPTTHRBEED
SCHEMBL192925 0.87 GPR119 (0.50) GPR119KDM4EMAPTTHRBEED
SCHEMBL3685040 0.86 GPR119 (0.49) GPR119KDM4EMAPTTHRBEED
SCHEMBL1433174 0.84 GPR119 (0.48) GPR119KDM4EMAPTTHRBEED
SCHEMBL15717199 0.83 BAZ2A (0.40) KDM4E
SCHEMBL15717197 0.83 BAZ2A (0.40) KDM4E
SCHEMBL2454658 0.82 FAAH (0.38) HTT
SCHEMBL15718159 0.82 FAAH (0.38) HTT
SCHEMBL2454657 0.82 FAAH (0.38) HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114761403-B 1- (4- (4- (5-Phenyl-4, 5-dihydro-isoxazol-3-yl) thiazol-2-yl) piperidin-1-yl) -ethan-1-one derivatives and related compounds as crop protection fungicides PI工业有限公司 2024-08-27 CN disclosed
CN-115052875-B 4- (4, 5-Dihydroisoxazol-3-yl) thiazol-2-yl) piperidine-thioimine or sulphoxide-imine derivatives and related compounds as fungicides for crop protection PI工业有限公司 2024-07-12 CN disclosed
EP-2670747-B1 HETEROARYL PIPERIDINE AND HETEROARYL PIPERAZINE DERIVATIVES AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2023-07-19 EP disclosed
CN-115052875-A 4- (4- (4, 5-dihydroisoxazol-3-yl) thiazol-2-yl) piperidinethimine or sulfoximine derivatives as fungicides for crop protection and related compounds PI工业有限公司 2022-09-13 CN disclosed
CN-114761403-A 1- (4- (4- (5-phenyl-4, 5-dihydroisoxazol-3-yl) thiazol-2-yl) piperidin-1-yl) -ethan-1-one derivatives and related compounds as crop protection fungicides PI工业有限公司 2022-07-15 CN disclosed
EP-3241829-B1 HETEROARYLPIPERIDINE AND -PIPERAZINE DERIVATIVES AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2020-12-23 EP disclosed
CN-111655687-A Novel fungicidal heterocyclic compounds PI工业有限公司 2020-09-11 CN disclosed
EP-2603508-B1 HETEROARYLPIPERIDINE AND -PIPERAZINE DERIVATIVES AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2019-03-13 EP disclosed
US-10004232-B2 Piperidine pyrazoles as fungicides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2018-06-26 US disclosed
EP-2609094-B1 HETEROARYLPIPERIDINE AND -PIPERAZINE DERIVATIVES AS FUNGICIDES BAYER IP GMBH (DE) 2018-05-30 EP disclosed
CN-102781937-A Bis(difluormethyl)pyrazoles used as fungicides BAYER CROPSCIENCE AG 2012-11-14 CN disclosed
EP-2516426-A1 BIS(DIFLUORMETHYL)PYRAZOLES USED AS FUNGICIDES Bayer CropScience AG (DE) 2012-10-31 EP disclosed
US-20120245204-A1 Unknown BAYER CROPSCIENCE AG (DE) 2012-09-27 US disclosed
US-20120122928-A1 Heteroarylpiperidine and -Piperazine Derivatives as Fungicides BAYER CROPSCIENCE AG (DE) 2012-05-17 US disclosed
US-20120122929-A1 HETEROARYLPIPERIDINE AND -PIPERAZINE DERIVATIVES AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2012-05-17 US disclosed
WO-2012025557-A1 HETEROARYLPIPERIDINE AND -PIPERAZINE DERIVATIVES AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2012-03-01 WO disclosed
EP-2423210-A1 Heteroarylpiperidine and heteroarylpiperazine derivatives as fungicides Bayer CropScience AG (DE) 2012-02-29 EP disclosed
WO-2012020060-A1 HETEROARYLPIPERIDINE AND -PIPERAZINE DERIVATIVES AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2012-02-16 WO disclosed
US-20110224257-A1 Bis(difluoromethyl)pyrazoles as Fungicides BAYER CROPSCIENCE AG (DE) 2011-09-15 US disclosed
WO-2011076699-A1 BIS(DIFLUORMETHYL)PYRAZOLES USED AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2011-06-30 WO 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 (5 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-20120122929-A1 HETEROARYLPIPERIDINE AND -PIPERAZINE DERIVATIVES AS FUNGICIDES CYP1A1, PRXL2A, CYP1A2 GPR119 2415/4885KDM4E 1830/4885MAPT 3865/4885
US-10004232-B2 Piperidine pyrazoles as fungicides CAT, PIR, CYP51A1 GPR119 2529/4885KDM4E 1914/4885MAPT 3443/4885
US-20110224257-A1 Bis(difluoromethyl)pyrazoles as Fungicides CYP1A1, CYP4X1, CYP2F1 GPR119 2184/4885KDM4E 2370/4885MAPT 2249/4885
US-20120245204-A1 Unknown CYP4Z1, DPM1, ERG28 GPR119 3763/4885KDM4E 2169/4885MAPT 2379/4885
US-20120122928-A1 Heteroarylpiperidine and -Piperazine Derivatives as Fungicides CYP1A1, PRXL2A, CYP1A2 GPR119 2499/4885KDM4E 1773/4885MAPT 3860/4885

“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.