SCHEMBL2549983

SCHEMBL2549983

CC1C2CC3(C)CC1CC(C)(C2)C3

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 4/20 0.35
GRIN2A Q12879 4/20 0.35
GRIN2D O15399 3/20 0.35
GRIN3B O60391 3/20 0.35
GRIN2B Q13224 3/20 0.35
GRIN2C Q14957 3/20 0.35
GRIN3A Q8TCU5 3/20 0.35
LMNA P02545 2/20 0.35
SLC22A1 O15245 1/20 0.35
ESR1 P03372 1/20 0.35
ADRB3 P13945 1/20 0.35
ACHE P22303 1/20 0.35
OPRK1 P41145 1/20 0.35
MTOR P42345 1/20 0.35
HTT P42858 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
NFKB1 P19838 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL9115343 0.69 LMNA (0.31) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
SCHEMBL8940989 0.69 GRIN1 (0.36) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
SCHEMBL2545728 0.69 LMNA (0.31) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
SCHEMBL11699962 0.69 GRIN1 (0.34) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
SCHEMBL28016129 0.67 PKM (0.31)
SCHEMBL733849 0.65 GRIN1 (0.48) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
SCHEMBL3190483 0.65 GRIN1 (0.48) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
Bromide SCHEMBL4732099 0.62 GRIN1 (0.46) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
SCHEMBL812216 0.62 GRIN1 (0.68) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
SCHEMBL11405480 0.62 PKM (0.44) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112684082-A Method for identifying crude oil type 中国石油化工股份有限公司 2021-04-20 CN claimed
CN-117007725-B Column chromatography sample online concentration device, method and application 大庆油田有限责任公司 2025-02-21 CN disclosed
CN-117007725-A Column chromatography sample online concentration device, method and application 大庆油田有限责任公司 2023-11-07 CN disclosed
CN-112684082-A Method for identifying crude oil type 中国石油化工股份有限公司 2021-04-20 CN disclosed
EP-2331495-B1 PROCESS FOR MANUFACTURING ADAMANTANE DERIVATIVES WITH HIGH YIELD MERZ PHARMA GMBH & CO KGAA (DE) 2016-01-27 EP disclosed
US-8796491-B2 Process for manufacturing adamantane derivatives with high yield MERZ PHARMA GMBH & CO. KGAA (DE) 2014-08-05 US disclosed
US-20110263900-A1 PROCESS FOR MANUFACTURING ADAMANTANE DERVATIVES WITH HIGH YIELD MERZ PHARMA GMBH & CO. KGAA (DE) 2011-10-27 US disclosed
EP-0715612-A4 1996-07-03 EP disclosed
EP-0715612-A1 ISOLATION OF HIGH PURITY DIAMONDOID, FRACTIONS AND COMPONENTS MOBIL OIL CORPORATION (US) 1996-06-12 EP disclosed
WO-1995011472-A1 FIBER OPTIC CABLE AND VISCOUS FILLER MATERIAL MOBIL OIL CORPORATION (US) 1995-04-27 WO disclosed
WO-1995006019-A1 ISOLATION OF HIGH PURITY DIAMONDOID, FRACTIONS AND COMPONENTS MOBIL OIL CORPORATION (US) 1995-03-02 WO disclosed
WO-1995001319-A1 OXIDATIVE COUPLING OF DIAMONDOIDS AND AROMATICS MOBIL OIL CORPORATION (US) 1995-01-12 WO disclosed
WO-1994029244-A1 LUBRICANT COMPOSITION AND METHOD FOR INCREASING DIAMONDOID INCORPORATION IN POLYALPHAOLEFIN-CONTAINING LUBRICANT MOBIL OIL CORPORATION (US) 1994-12-22 WO disclosed
US-4043927-A Friction or tractive drive containing ethers of adamantanes SUN VENTURES, INC. (US) 1977-08-23 US disclosed
US-4008251-A TRACTION FLUID ADDITIVES SUN OIL COMPANY, (SUN RESEARCH AND DEVELOPMENT CO.) 1977-02-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110263900-A1 PROCESS FOR MANUFACTURING ADAMANTANE DERVATIVES WITH HIGH YIELD BACE1, BACE2, APP GRIN1 958/4885GRIN2A 870/4885GRIN2D 1299/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.