SCHEMBL6858663

SCHEMBL6858663

CCC(C)CCc1[nH]nnc1Br

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
SCHEMBL5284443 0.77
SCHEMBL5277630 0.73 HCAR2 (0.42)
SCHEMBL5283737 0.72
SCHEMBL19686139 0.66 LMNA (0.34)
SCHEMBL5280326 0.63
SCHEMBL20780593 0.58 MAPK1 (0.49)
SCHEMBL109285 0.57 TSHR (0.40)
SCHEMBL19004724 0.57 TSHR (0.40)
SCHEMBL12719675 0.57 GABRA1 (0.31)
SCHEMBL5276188 0.56 HCAR3 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1113035-B1 Polymer and macromolecular solid electrolyte containing the same NIPPON CATALYTIC CHEM IND (JP) 2004-04-28 EP disclosed
US-6498230-B2 EXHIBITING HIGH ELECTROCONDUCTIVITY AT LOW TEMPERATURES; EFFICIENCY; FUEL CELLS NIPPON SHOKUBAI CO., LTD. (JP) 2002-12-24 US disclosed
US-20010020084-A1 Polymer and macromolecular solid electrolyte containing the same NIPPON SHOKUBAI CO., LTD. (JP) 2001-09-06 US disclosed
EP-1113035-A2 Polymer and macromolecular solid electrolyte containing the same Nippon Shokubai Co., Ltd. (JP) 2001-07-04 EP disclosed