SCHEMBL7476506

SCHEMBL7476506

CC(C)C(C)(O[C]=O)C(C)C

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL3035101 0.81
SCHEMBL271041 0.77
SCHEMBL3035585 0.72
SCHEMBL3206089 0.72
SCHEMBL5349383 0.72
SCHEMBL8751772 0.70
SCHEMBL277028 0.69
SCHEMBL754334 0.67 TDP1 (0.31)
SCHEMBL1670 0.67
SCHEMBL3035035 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0935601-A4 ARYLAMINO FUSED PYRIDINES AND PYRIMIDINES DU PONT PHARM CO (US) 2002-08-07 EP disclosed
EP-0935601-A2 ARYLAMINO FUSED PYRIDINES AND PYRIMIDINES Du Pont Pharmaceuticals Company (US) 1999-08-18 EP disclosed
WO-1997035539-A2 ARYLAMINO FUSED PYRIDINES AND PYRIMIDINES DU PONT PHARMACEUTICALS COMPANY (US) 1997-10-02 WO disclosed
WO-1990005742-A1 FISH CRF THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1990-05-31 WO disclosed
EP-0227824-A4 SYNTHETIC PEPTIDE-BASED ANTI-RABIES COMPOSITIONS AND METHODS. SALK INST FOR BIOLOGICAL STUDI (US) 1989-09-26 EP disclosed
EP-0227824-A1 SYNTHETIC PEPTIDE-BASED ANTI-RABIES COMPOSITIONS AND METHODS THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1987-07-08 EP disclosed
WO-1987000179-A1 SYNTHETIC PEPTIDE-BASED ANTI-RABIES COMPOSITIONS AND METHODS THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1987-01-15 WO disclosed