SCHEMBL2810799

SCHEMBL2810799

CC(C)c1cc2ccccc2c(C(C)C)c1C(C)C.[NaH]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.38
NCEH1 Q6PIU2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HIF1A Q16665 1/20 0.37
CYP1B1 Q16678 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CYP1A2 P05177 2/20 0.36
CYP2A6 P11509 1/20 0.36
CYP3A4 P08684 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
CYP2C19 P33261 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
GABRA1 P14867 1/20 0.34
GABRB2 P47870 1/20 0.34
UGT2B7 P16662 1/20 0.34
KIF11 P52732 1/20 0.34

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
SCHEMBL6932314 1.00 SIGMAR1 (0.38) SIGMAR1NCEH1ALDH1A1HIF1ACYP1B1
SCHEMBL72911 0.98 SIGMAR1 (0.39) SIGMAR1NCEH1ALDH1A1HIF1ACYP1B1
Hydrogen Sulfide SCHEMBL28277787 0.96 SIGMAR1 (0.38) SIGMAR1NCEH1ALDH1A1HIF1ACYP1B1
SCHEMBL2810800 0.96 SIGMAR1 (0.38) SIGMAR1NCEH1ALDH1A1HIF1ACYP1B1
SCHEMBL6932320 0.96 SIGMAR1 (0.38) SIGMAR1NCEH1ALDH1A1HIF1ACYP1B1
SCHEMBL27480348 0.89 ALDH1A1 (0.41) SIGMAR1NCEH1ALDH1A1HIF1ACYP1B1
Sulfuric Acid SCHEMBL11418513 0.88 NCEH1 (0.39) SIGMAR1NCEH1ALDH1A1HSD17B10CYP1A2
Sulfuric Acid SCHEMBL5185864 0.86 HMGCR (0.36) SIGMAR1NCEH1CYP1A2CYP3A4GAA
SCHEMBL11204985 0.86 NCEH1 (0.38) SIGMAR1NCEH1ALDH1A1HSD17B10CYP1A2
Sulfuric Acid SCHEMBL3025774 0.86 NCEH1 (0.35) SIGMAR1NCEH1CYP1A2CYP3A4GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109641883-B Plant growth regulator compounds 先正达参股股份有限公司 2022-12-16 CN disclosed
CN-115362147-A Herbicidal compounds 先正达农作物保护股份公司 2022-11-18 CN disclosed
CN-109890796-B Herbicidal pyridazinone compounds 先正达参股股份有限公司 2022-10-11 CN disclosed
CN-114728916-A Herbicidal compounds 先正达农作物保护股份公司 2022-07-08 CN disclosed
CN-114555563-A Substituted pyridazinones as herbicides 先正达农作物保护股份公司 2022-05-27 CN disclosed
CN-114222733-A Cyclic diones as herbicidal compounds 先正达农作物保护股份公司 2022-03-22 CN disclosed
CN-114080384-A Herbicidal cyclohexanedione derivatives 先正达农作物保护股份公司 2022-02-22 CN disclosed
CN-114080385-A Herbicidal compounds 先正达农作物保护股份公司 2022-02-22 CN disclosed
CN-113423692-A Substituted azaspiro rings as herbicides 先正达农作物保护股份公司 2021-09-21 CN disclosed
CN-113423693-A Herbicidal compounds 先正达农作物保护股份公司 2021-09-21 CN disclosed
EP-0058694-B1 METHOD OF RECOVERING A PHOTOGRAPHIC ADDENDUM FROM A DISPERSION THEREOF EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1985-07-10 EP disclosed
US-4504568-A Sensitive silver halide photothermographic materials for producing dye images EASTMAN KODAK COMPANY (US) 1985-03-12 US disclosed
EP-0033232-B1 DEVELOPERS AND METHODS OF PROCESSING RADIATION SENSITIVE PLATES USING THE SAME Vickers Limited (GB) 1984-06-06 EP disclosed
US-4427764-A DI-HIGHER ALKYL PHTHALATE KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1984-01-24 US disclosed
US-4350756-A DEVELOPMENT WITH AQUEOUS SOLUTION OF NONIONIC SURFACTANT, ALIPHATIC AND AROMATIC ACID SALTS VICKERS LIMITED (GB) 1982-09-21 US disclosed
EP-0058694-A1 METHOD OF RECOVERING A PHOTOGRAPHIC ADDENDUM FROM A DISPERSION THEREOF. EASTMAN KODAK CO (US) 1982-09-01 EP disclosed
WO-1982000901-A1 METHOD OF RECOVERING A PHOTOGRAPHIC ADDENDUM FROM A DISPERSION THEREOF YOUNG D 1982-03-18 WO disclosed
EP-0047170-A1 Method of recovering a photographic addendum from a dispersion thereof EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1982-03-10 EP disclosed
EP-0033232-A1 Developers and methods of processing radiation sensitive plates using the same Vickers Limited (GB) 1981-08-05 EP disclosed
US-4224404-A Production of specific immune nucleic acids cell dialysates and antibodies THE INTERNATIONAL INSTITUTE OF DIFFERENTIATION LIMITED (GB) 1980-09-23 US disclosed