SCHEMBL6933331

SCHEMBL6933331

CCCCC(CC)Cc1c(C)ccc2c1nnn2CN

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 3/20 0.35
ALDH1A1 P00352 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
XBP1 P17861 1/20 0.32
PPARG P37231 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
NCOA3 Q9Y6Q9 1/20 0.32
SLC9A1 P19634 1/20 0.30

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
SCHEMBL28495537 0.85 GRM2 (0.32) GRM2ALDH1A1TDP1KDM4EMEN1
SCHEMBL30014300 0.84 GRM2 (0.34) GRM2ALDH1A1TDP1KDM4EMEN1
SCHEMBL5162819 0.84 GRM2 (0.34) GRM2ALDH1A1TDP1KDM4EMEN1
SCHEMBL4043773 0.82 ALDH1A1 (0.32) ALDH1A1TDP1
SCHEMBL28573878 0.81 GRM2 (0.43) GRM2ALDH1A1TDP1KDM4EMEN1
SCHEMBL14332180 0.80 ALDH1A1 (0.32) ALDH1A1TDP1
SCHEMBL28935876 0.77 CRHR1 (0.35) ALDH1A1TDP1KDM4EMEN1GAA
SCHEMBL28935093 0.76 ALDH1A1 (0.31) ALDH1A1TDP1KDM4EMEN1GAA
SCHEMBL28935905 0.76 ALDH1A1 (0.34) ALDH1A1TDP1KDM4EMEN1GAA
SCHEMBL20942794 0.75 GRM2 (0.42) GRM2ALDH1A1TDP1KDM4EMEN1

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110713868-A Post etch residue cleaning solution capable of removing titanium nitride 巴斯夫欧洲公司 2020-01-21 CN claimed
CN-115443325-B Lubricant composition and use thereof 克鲁勃润滑剂慕尼黑两合欧洲公司 2024-07-09 CN disclosed
CN-115003775-B Colorant for heat transfer fluid and composition containing same KD精细化工有限公司 2024-03-19 CN disclosed
CN-114787288-B Colorant for heat transfer fluid and composition containing same KD精细化工有限公司 2024-02-13 CN disclosed
CN-117501469-A Composition for forming thin film for electrode of energy storage device 日产化学株式会社 2024-02-02 CN disclosed
CN-116601262-A Heat transfer fluid compositions with improved thermal stability KD精细化工有限公司 2023-08-15 CN disclosed
CN-116472324-A Cooling liquid composition for electric automobile KD精细化工有限公司 2023-07-21 CN disclosed
EP-4143281-A1 LUBRICANT COMPOSITION AND USE THEREOF Klüber Lubrication München SE & Co. KG (DE) 2023-03-08 EP disclosed
EP-4143277-A1 LUBRICANT COMPOSITION AND USE THEREOF Klüber Lubrication München SE & Co. KG (DE) 2023-03-08 EP disclosed
CN-115443322-A Lubricant composition and use thereof 克鲁勃润滑剂慕尼黑两合欧洲公司 2022-12-06 CN disclosed
CN-115443325-A Lubricant composition and use thereof 克鲁勃润滑剂慕尼黑两合欧洲公司 2022-12-06 CN disclosed
CN-115315502-A Grease composition for resin lubrication 协同油脂株式会社 2022-11-08 CN disclosed
CN-115003775-A Colorants for heat transfer fluids and compositions containing the same KD精细化工有限公司 2022-09-02 CN disclosed
CN-114787288-A Colorant for heat transfer fluid and composition comprising same KD精细化工有限公司 2022-07-22 CN disclosed
CN-111212893-B Regeneration of high viscosity waste lubricants with polyethers 国际壳牌研究有限公司 2022-05-24 CN disclosed
CN-111212893-A Regeneration of high viscosity waste lubricants with polyethers 国际壳牌研究有限公司 2020-05-29 CN disclosed
CN-108292539-B Cable comprising a foamed layer comprising a polyolefin polymer and a blowing agent 博里利斯股份公司 2020-05-22 CN disclosed
CN-110713868-A Post etch residue cleaning solution capable of removing titanium nitride 巴斯夫欧洲公司 2020-01-21 CN disclosed
EP-0976813-B1 Borate containing additive for manual transmission lubricant being stable to hydrolysis and providing high synchromesh durability CHEVRON ORONITE SA (FR) 2003-12-10 EP disclosed
EP-0976813-A1 Borate containing additive for manual transmission lubricant being stable to hydrolysis and providing high synchromesh durability Chevron Chemical S.A. (FR) 2000-02-02 EP disclosed