SCHEMBL5996744

SCHEMBL5996744

CNc1nnc(C(C)(C)C)s1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
CA4 P22748 1/20 0.55
CA5A P35218 1/20 0.55
CA5B Q9Y2D0 1/20 0.55
KMT2A Q03164 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
MEN1 O00255 2/20 0.52
CYP1A2 P05177 1/20 0.52
PTGS1 P23219 1/20 0.46
PTGS2 P35354 1/20 0.46
ALDH1A1 P00352 6/20 0.45
MAPT P10636 3/20 0.45
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
HSD17B10 Q99714 1/20 0.45
RAB9A P51151 5/20 0.45
NPC1 O15118 4/20 0.45
PKM P14618 2/20 0.45
LMNA P02545 1/20 0.45

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
Hydrochloric Acid SCHEMBL9506373 0.98 CA1 (0.53) CA1CA2CA4CA5ACA5B
Toluene SCHEMBL28660791 0.84 ALDH1A1 (0.52) CA1CA2CA4CA5ACA5B
SCHEMBL9102180 0.79 CA1 (0.53) CA1CA2CA4CA5ACA5B
SCHEMBL10987455 0.79 CA1 (0.58) CA1CA2CA4CA5ACA5B
SCHEMBL28674576 0.79 CA1 (0.53) CA1CA2CA4CA5ACA5B
SCHEMBL14012564 0.79 CA1 (0.53) CA1CA2CA4CA5ACA5B
SCHEMBL11721552 0.77 CNR2 (0.41) CA1CA2CA4CA5ACA5B
SCHEMBL11584394 0.76
SCHEMBL254763 0.76 CA1 (0.46) CA1CA2CA4CA5ACA5B
SCHEMBL10220180 0.76 CA1 (0.50) CA1CA2CA4CA5ACA5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118638076-A Preparation method of 2-methylamino-5-tert-butyl-1, 3, 4-thiadiazole 湖南化工研究院有限公司 2024-09-13 CN claimed
CN-118084821-A Preparation method of tebuthiuron 湖南化工研究院有限公司 2024-05-28 CN claimed
CN-117986169-A Synthesis method of intermediate 4-methylaminothiourea of 2-methylamino-5-tert-butyl-1, 3, 4-thiadiazole 宁夏常晟药业有限公司 2024-05-07 CN claimed
CN-117603160-A Synthesis method of high-purity tebuthiuron 山东华阳农药化工集团有限公司 2024-02-27 CN claimed
CN-218854256-U Variable pressure type synthetic reaction system of tebuthiuron 江苏常隆农化有限公司 2023-04-14 CN claimed
CN-113620905-A Industrial production method of tebuthiuron technical 江苏快达农化股份有限公司 2021-11-09 CN claimed
CN-110372634-B Method for synthesizing 2-methylamino-5-tert-butyl-1, 3, 4-thiadiazole 宁夏常晟药业有限公司 2021-03-19 CN claimed
CN-110372634-A A method of synthesis 2- methylamino -5- tert-butyl -1,3,4- thiadiazoles 宁夏晟丰元化工有限公司 2019-10-25 CN claimed
CN-109251188-A A kind of preparation method of 2- methylamino -5- tert-butyl -1,3,4- thiadiazoles 河北工业大学 2019-01-22 CN claimed
CN-105524017-A Preparation method of 2-methylamino-5-t-butyl-1,3,4-thiadiazole JIANGSU HANLIAN BIOTECHNOLOGY CO LTD 2016-04-27 CN claimed
US-4987233-A Process for preparing herbicidal ureas and insecticidal carbamates and carbamate derivatives ELI LILLY AND COMPANY (US) 1991-01-22 US claimed
US-4283543-A Process for preparing the compound 5-t-butyl-2-methylamino-1,3,4-triadiazole MORTON-NORWICH PRODUCTS, INC. (US) 1981-08-11 US claimed
CN-118638076-B Preparation method of 2-methylamino-5-tert-butyl-1, 3, 4-thiadiazole 湖南化工研究院有限公司 2026-04-28 CN disclosed
CN-118638076-B Preparation method of 2-methylamino-5-tert-butyl-1, 3, 4-thiadiazole 湖南化工研究院有限公司 2026-04-28 CN disclosed
CN-121758393-A Synthesis method of 2-methylamino-5-tert-butyl-1, 3, 4-thiadiazole 宁夏常晟药业有限公司 2026-03-31 CN disclosed
CN-121758393-A Synthesis method of 2-methylamino-5-tert-butyl-1, 3, 4-thiadiazole 宁夏常晟药业有限公司 2026-03-31 CN disclosed
US-4283543-A Process for preparing the compound 5-t-butyl-2-methylamino-1,3,4-triadiazole MORTON-NORWICH PRODUCTS, INC. (US) 1981-08-11 US disclosed
US-4237066-A Preparation of lower alkyl thiosemicarbazides MOBAY CHEMICAL CORPORATION (US) 1980-12-02 US disclosed
US-4132736-A Preparation of 4-alkylthiosemicarbazides BAYER AKTIENGESELLSCHAFT (DE) 1979-01-02 US disclosed
US-4086077-A 1,3-DIMETHYL-1-(5-TERT-BUTYL-1,3,4-THIADIAZOL-2-YL) UREA, HERBICIDES GULF RESEARCH & DEVELOPMENT COMPANY (US) 1978-04-25 US disclosed