SCHEMBL10413085

SCHEMBL10413085

CC(C)(C)OOC(C)(C)C.[KH]

nearest known ligand 0.89

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.89
TDP1 Q9NUW8 1/20 0.89
ALDH1A1 P00352 2/20 0.42

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
SCHEMBL14861 0.94 TDP1 (1.00) TSHRTDP1ALDH1A1
SCHEMBL28236221 0.94 TDP1 (1.00) TSHRTDP1ALDH1A1
SCHEMBL28783887 0.89 TSHR (0.89) TSHRTDP1ALDH1A1
Methane SCHEMBL3208996 0.89 TSHR (0.89) TSHRTDP1ALDH1A1
SCHEMBL30468193 0.89 TSHR (0.89) TSHRTDP1ALDH1A1
Hydrochloric Acid SCHEMBL25381110 0.89 TSHR (0.89) TSHRTDP1ALDH1A1
SCHEMBL28844257 0.89 TSHR (0.89) TSHRTDP1ALDH1A1
SCHEMBL7526385 0.89 TSHR (0.89) TSHRTDP1ALDH1A1
Water SCHEMBL2208354 0.89 TSHR (0.89) TSHRTDP1ALDH1A1
SCHEMBL196691 0.89 TSHR (0.89) TSHRTDP1ALDH1A1

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
CN-113292470-B Continuous flow synthesis process of peroxy-2-ethylhexyl tert-butyl carbonate without amplification effect 上海惠和化德生物科技有限公司 2023-01-24 CN disclosed
CN-111363069-B Preparation method of polyvinyl chloride resin composite initiator 乌鲁木齐市华泰隆化学助剂有限公司 2022-04-19 CN disclosed
CN-113292470-A Continuous flow synthesis process of peroxy-2-ethylhexyl tert-butyl carbonate without amplification effect 上海惠和化德生物科技有限公司 2021-08-24 CN disclosed
CN-107698480-B Continuous flow synthesis process of tert-butyl peroxyneodecanoate without amplification effect 上海惠和化德生物科技有限公司 2020-09-11 CN disclosed
CN-111363069-A Preparation method of polyvinyl chloride resin composite initiator 乌鲁木齐市华泰隆化学助剂有限公司 2020-07-03 CN disclosed
CN-110072401-A Glove, composition for dip molding, and method for producing glove 绿安全股份有限公司 2019-07-30 CN disclosed
CN-106103570-B Gloves and gloves composition 高产有限公司 2018-08-10 CN disclosed
CN-105330871-A Potassium humate and preparation technology thereof SONG SHUQIN 2016-02-17 CN disclosed
US-4980485-A Method of manufacturing optically-active periplanone-b JAPAN TOBACCO INC. (JP) 1990-12-25 US disclosed
US-4755626-A 4-isopropyl-7-methylene-5-cyclodecen-1-ol JAPAN TOBACCO, INC. (JP) 1988-07-05 US disclosed