SCHEMBL2912574

SCHEMBL2912574

COc1ccc(CN2CC(O[Si](C)(C)C)C2)cc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.54
SIGMAR1 Q99720 2/20 0.51
DRD4 P21917 6/20 0.49
KCNH2 Q12809 1/20 0.47
MCHR1 Q99705 1/20 0.47
PTGIR P43119 1/20 0.47
DRD2 P14416 1/20 0.45
DRD3 P35462 1/20 0.45
HRH2 P25021 1/20 0.45
ACHE P22303 1/20 0.44
GRM2 Q14416 1/20 0.44
POLB P06746 1/20 0.44

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
SCHEMBL2919409 0.84 S1PR1 (0.48) SMN1; SMN2SIGMAR1DRD4POLB
SCHEMBL2921985 0.84 S1PR5 (0.46) SIGMAR1DRD4DRD2DRD3GRM2
SCHEMBL2919442 0.83 S1PR5 (0.44) SIGMAR1DRD4GRM2
SCHEMBL2910904 0.82 SIGMAR1 (0.57) SIGMAR1DRD2DRD3
SCHEMBL2921823 0.82 FUCA1 (0.50) SIGMAR1DRD4DRD2DRD3ACHE
SCHEMBL2917808 0.81 SIGMAR1 (0.52) SMN1; SMN2SIGMAR1DRD4ACHE
SCHEMBL2432513 0.79 SMN1; SMN2 (0.58) SMN1; SMN2SIGMAR1DRD4PTGIRDRD2
SCHEMBL15958463 0.78 SMN1; SMN2 (0.57) SMN1; SMN2SIGMAR1DRD4PTGIRDRD2
SCHEMBL15399382 0.78 SMN1; SMN2 (0.57) SMN1; SMN2SIGMAR1DRD4PTGIRDRD2
SCHEMBL2918073 0.77 SIGMAR1 (0.57) SMN1; SMN2SIGMAR1DRD4PTGIRHRH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1784407-B1 2-ARYLMETHYLAZETIDINE CARBAPENEM DERIVATIVES AND PREPARATION THEREOF KOREA RES INST CHEM TECH (KR) 2010-09-08 EP disclosed
US-7662810-B2 Potassium(1R,5S,6S)-2-(1-benzyl-azetidine-3-yl-thio)-6-[(1R)-1-hydroxyethyl]-1-methylcarbapen-2-em-3-carboxylate; antibacterial activities against Grampositive and Gramnegative bacteria and excellent antibacterial activities against resistant bacteria such as methicillin resistant Staphylococcus aureus KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2010-02-16 US disclosed
EP-1784407-A4 2-ARYLMETHYLAZETIDINE CARBAPENEM DERIVATIVES AND PREPARATION THEREOF KOREA RES INST CHEM TECH (KR) 2009-02-11 EP disclosed
US-20070244089-A1 2- Arylmethylazetidine Carbapenem Derivatives and Preparation Thereof KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2007-10-18 US disclosed
EP-1784407-A1 2-ARYLMETHYLAZETIDINE CARBAPENEM DERIVATIVES AND PREPARATION THEREOF Korea Research Institute of Chemical Technology (KR) 2007-05-16 EP disclosed
WO-2006025634-A1 2-ARYLMETHYLAZETIDINE CARBAPENEM DERIVATIVES AND PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2006-03-09 WO 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-20070244089-A1 2- Arylmethylazetidine Carbapenem Derivatives and Preparation Thereof SCN9A, SCN2A, SCN5A SMN1; SMN2 1150/4885SIGMAR1 2493/4885DRD4 2699/4885

“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.