SCHEMBL2812950

SCHEMBL2812950

[CH2]c1cc(Br)c(C)s1

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
SCHEMBL2812953 0.72
SCHEMBL2813210 0.72
SCHEMBL4627777 0.72 HCAR3 (0.32)
SCHEMBL9769048 0.72
SCHEMBL566671 0.72
SCHEMBL915725 0.68
SCHEMBL15942721 0.68
SCHEMBL14546650 0.65
SCHEMBL7791817 0.65 NR1D1 (0.33)
SCHEMBL15249603 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7435742-B2 Quinuclidine derivatives and pharmaceutical compositions containing the same LABORATORIOS ALMIRALL S.A. (ES) 2008-10-14 US claimed
US-20060094751-A1 Quinuclidine derivatives and pharmaceutical compositions containing the same ALMIRALL, S.A. (ES) 2006-05-04 US claimed
EP-1515968-A2 QUINUCLIDINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME Almirall Prodesfarma AG (CH) 2005-03-23 EP claimed
WO-2004000840-A2 QUINUCLIDINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME ALMIRALL PRODESFARMA AG (CH) 2003-12-31 WO claimed
CN-106715418-A Therapeutic compounds and methods of use thereof 基因泰克公司 2017-05-24 CN disclosed
US-20100249420-A9 Process for preparing quinuclidinium carbamate derivatives LABORATORIOS ALMIRALL S.A. (ES) 2010-09-30 US disclosed
US-20090198064-A1 Process for preparing quinuclidinium carbamate derivatives LABORATORIOS ALMIRALL S.A. (ES) 2009-08-06 US disclosed
EP-1781651-B1 PROCESS FOR PREPARING QUINUCLIDINIUM CARBAMATE DERIVATIVES ALMIRALL LAB (ES) 2009-03-11 EP disclosed
US-20090054480-A1 NOVEL QUINUCLIDINE CARBAMATE DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME LABORATORIOS ALMIRALL S.A. 2009-02-26 US disclosed
US-20090005412-A1 NOVEL QUINUCLIDINE DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME LABORATORIOS ALMIRALL S.A. 2009-01-01 US disclosed
US-7435742-B2 Quinuclidine derivatives and pharmaceutical compositions containing the same LABORATORIOS ALMIRALL S.A. (ES) 2008-10-14 US disclosed
EP-1781651-A1 PROCESS FOR PREPARING QUINUCLIDINIUM CARBAMATE DERIVATIVES Laboratorios Almirall, S.A. (ES) 2007-05-09 EP disclosed
US-20060094751-A1 Quinuclidine derivatives and pharmaceutical compositions containing the same ALMIRALL, S.A. (ES) 2006-05-04 US disclosed
WO-2006010452-A1 PROCESS FOR PREPARING QUINUCLIDINIUM CARBAMATE DERIVATIVES LABORATORIOS ALMIRALL, S.A. (ES) 2006-02-02 WO disclosed
EP-1515968-A2 QUINUCLIDINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME Almirall Prodesfarma AG (CH) 2005-03-23 EP disclosed
WO-2004000840-A2 QUINUCLIDINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME ALMIRALL PRODESFARMA AG (CH) 2003-12-31 WO disclosed