SCHEMBL2406537

SCHEMBL2406537

CCCCCC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 4/20 0.61
GRIN3B O60391 4/20 0.61
GRIN1 Q05586 4/20 0.61
GRIN2A Q12879 4/20 0.61
GRIN2B Q13224 4/20 0.61
GRIN2C Q14957 4/20 0.61
GRIN3A Q8TCU5 4/20 0.61
EPHX2 P34913 7/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
ALDH1A1 P00352 2/20 0.44
MAPT P10636 1/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 1/20 0.39
GBA1 P04062 1/20 0.38
GBA2 Q9HCG7 1/20 0.38

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
SCHEMBL27620610 0.98 GRIN2D (0.59) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL4301888 0.98 GRIN2D (0.59) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8947159 0.98 GRIN2D (0.59) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL293783 0.93 GRIN2D (0.60) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5647592 0.93 GRIN2D (0.60) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8626986 0.90 GRIN2D (0.48) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL10957944 0.87 GRIN2D (0.76) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Ammonia Solution, Strong SCHEMBL28147134 0.87 GRIN2D (0.48) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5713357 0.86 GRIN2D (0.47) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL25398209 0.85 GRIN2D (0.45) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107417530-B Bicarboxylate compound for nonaqueous electrolyte, nonaqueous electrolyte containing same and secondary battery 微宏动力系统(湖州)有限公司 2021-02-09 CN claimed
CN-105826596-B Preparation method of ionic liquid and secondary battery 微宏动力系统(湖州)有限公司 2020-11-06 CN claimed
CN-111574458-A Synthetic method of ergothioneine 上海克琴科技有限公司 2020-08-25 CN claimed
CN-107417569-B Tertiary nitrile compound for non-aqueous electrolyte, non-aqueous electrolyte containing same and secondary battery 微宏动力系统(湖州)有限公司 2020-04-14 CN claimed
CN-108136207-A Combination therapy for the treatment of cancer 红山生物医药有限公司 2018-06-08 CN claimed
US-20130029232-A1 LITHIUM ION SECONDARY BATTERY INCLUDING IONIC LIQUID ELECTROLYTE Microvast New Materials (Huzhou) Co., LTD. (CN) 2013-01-31 US claimed
CN-100338834-C Organic vertical cavity laser element with organic active region EASTMAN KODAK CO (US) 2007-09-19 CN claimed
EP-1408591-B1 Organic vertical cavity lasing devices having organic active region EASTMAN KODAK CO (US) 2006-11-29 EP claimed
CN-1497812-A Organic vertical cavity laser element with organic active region 伊斯曼柯达公司 2004-05-19 CN claimed
CN-113574068-B Method of inducing an anti-cancer immune response 艾宝奇生物工艺有限公司 2024-07-23 CN disclosed
CN-112999222-B Treatment for inhibiting replication of single stranded RNA viruses 红山生物医药有限公司 2024-05-28 CN disclosed
CN-116730814-A Novel naphthoquinone intermediate, preparation method thereof, chiral naphthalene compound and preparation method thereof 香港科技大学深圳研究院 2023-09-12 CN disclosed
CN-116157382-A Material for metal patterning, amine compound, electronic device, and method for forming metal pattern 东曹株式会社 2023-05-23 CN disclosed
CN-111574458-B Synthetic method of ergothioneine 上海克琴科技有限公司 2023-04-07 CN disclosed
US-5981420-A OXIDATION CATALYSTS SYSTEM CONSISTS OF AN N-HYDROXY OR N-OXY IMIDE COMPOUND AND A TRANSITION METAL COMPOUND EXCLUDING A POLYACID AS COCATALYST DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1999-11-09 US disclosed
US-5958821-A EPOXIDATION OF AN ALKENE USING A CYCLIC N-HYDROXYIMIDE AND A COCATALYST OF A COMPOUND OF A GROUP 2A OR TRANSITION METAL USING OXYGEN; CATALYST SELECTIVITY; FREE OF PHOSPHO-VANADOMOLYBDIC ACID OR TETRAPHENYLPORPHYRINTOATO MANGANESE DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1999-09-28 US disclosed
CN-1209121-A Benzazepine Derivatives OTSUKA PHARMA CO LTD (JP) 1999-02-24 CN disclosed
EP-0858835-A1 Oxidation catalytic system and oxidation process Daicel Chemical Industries, Ltd. (JP) 1998-08-19 EP disclosed
EP-0824962-A1 OXIDATION CATALYST SYSTEM AND PROCESS FOR OXIDATION WITH THE SAME DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1998-02-25 EP disclosed
CN-1150799-A Benzoheterocyclic derivatives OTSUKA PHARMA CO LTD (JP) 1997-05-28 CN disclosed