SCHEMBL4123953

SCHEMBL4123953

CCCC(CC)[S+](C)[O-]

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
SCHEMBL11385298 0.80 LMNA (0.38)
SCHEMBL779887 0.80 CYP3A4 (0.31)
SCHEMBL1995923 0.79 DNM1 (0.35)
SCHEMBL20780468 0.77
SCHEMBL16612859 0.76
SCHEMBL21799386 0.72
SCHEMBL988639 0.72
SCHEMBL4188888 0.72
SCHEMBL20223164 0.72 CYP3A4 (0.37)
SCHEMBL24532390 0.70 CA2 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090215888-A1 TOPICAL NAIL FORMULATION NUVO RESEARCH INC. (CA) 2009-08-27 US claimed
CN-101296691-A transdermal drug delivery dosage form NUVO RES INC (CA) 2008-10-29 CN claimed
EP-1909772-A1 TRANSDERMAL DRUG DELIVERY FORMULATION Nuvo Research Inc. (CA) 2008-04-16 EP claimed
WO-2007098591-A2 TOPICAL NAIL FORMULATION NUVO RESEARCH INC. (CA) 2007-09-07 WO claimed
WO-2007016766-A1 TRANSDERMAL DRUG DELIVERY FORMULATION NUVO RESEARCH INC. (CA) 2007-02-15 WO claimed
CN-102225046-A Transdermal drug delivery formulation NUVO RES INC 2011-10-26 CN disclosed
CN-101296691-B Transdermal drug delivery dosage form NUVO RES INC 2011-07-27 CN disclosed
US-20090215888-A1 TOPICAL NAIL FORMULATION NUVO RESEARCH INC. (CA) 2009-08-27 US disclosed
US-20080319092-A1 Transdermal Drug Delivery Formulation NUVO RESEARCH INC. (CA) 2008-12-25 US disclosed
CN-101296691-A transdermal drug delivery dosage form NUVO RES INC (CA) 2008-10-29 CN disclosed
EP-1909772-A1 TRANSDERMAL DRUG DELIVERY FORMULATION Nuvo Research Inc. (CA) 2008-04-16 EP disclosed
WO-2007098591-A2 TOPICAL NAIL FORMULATION NUVO RESEARCH INC. (CA) 2007-09-07 WO disclosed
WO-2007016766-A1 TRANSDERMAL DRUG DELIVERY FORMULATION NUVO RESEARCH INC. (CA) 2007-02-15 WO disclosed