SCHEMBL12465422

SCHEMBL12465422

CC/C=C\CCSC

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
SCHEMBL8377751 0.83
SCHEMBL31411206 0.79 PTGS1 (0.39)
SCHEMBL31411207 0.79 PTGS1 (0.39)
SCHEMBL12518176 0.76 ALDH1A1 (0.48)
SCHEMBL25468801 0.74
SCHEMBL12817567 0.74
SCHEMBL13757902 0.74
SCHEMBL16288191 0.74
SCHEMBL14748107 0.74
SCHEMBL16287957 0.74

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9796696-B2 Substituted arylcyclopentenes as therapeutic agents ALLERGAN, INC. (US) 2017-10-24 US disclosed
US-9765065-B2 Therapeutic substituted cyclopentanes ALLERGAN, INC. (US) 2017-09-19 US disclosed
US-20170144999-A1 THERAPEUTIC SUBSTITUTED CYCLOPENTANES ALLERGAN, INC. 2017-05-25 US disclosed
US-9591935-B2 Therapeutic substituted cyclopentanes ALLERGEN, INC. (US) 2017-03-14 US disclosed
US-20170057941-A1 SUBSTITUTED ARYLCYCLOPENTENES AS THERAPEUTIC AGENTS ALLERGAN, INC. 2017-03-02 US disclosed
US-9365485-B2 Substituted arylcyclopentenes as therapeutic agents ALLERGAN, INC. (US) 2016-06-14 US disclosed
US-20150274658-A1 THERAPEUTIC LACTAMS ALLERGAN, INC. (US) 2015-10-01 US disclosed
US-20140323510-A1 SUBSTITUTED ARYLCYCLOPENTENES AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2014-10-30 US disclosed
US-8722726-B2 Substituted arylcyclopentenes as therapeutic agents ALLERGAN, INC. (US) 2014-05-13 US disclosed
US-20130231322-A1 THERAPEUTIC SUBSTITUTED BETA-LACTAMS ALLERGAN, INC. (US) 2013-09-05 US disclosed
US-7700627-B2 Therapeutic substituted lactams ALLERGAN, INC. (US) 2010-04-20 US disclosed
US-20090270387-A1 SUBSTITUTED ARYLCYCLOPENTENES AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2009-10-29 US disclosed
US-20090215740-A1 THERAPEUTIC SUBSTITUTED BETA-LACTAMS ALLERGAN, INC. (US) 2009-08-27 US disclosed
US-7576112-B2 Therapeutic N-aryl or N-heteroaryl pyrazolidine and pyrazolidinone derivatives ALLERGAN, INC. (US) 2009-08-18 US disclosed
WO-2009055289-A2 THERAPEUTIC SUBSTITUTED LACTAMS ALLERGAN, INC. (US) 2009-04-30 WO disclosed
US-20090099249-A1 THERAPEUTIC LACTAMS ALLERGAN, INC. 2009-04-16 US disclosed
US-7507817-B2 Glaucome therapy; vision defects ALLERGAN, INC. (US) 2009-03-24 US disclosed
US-20080167311-A1 Prostaglandin Prodrugs ALLERGAN, INC. 2008-07-10 US disclosed
US-20080119539-A1 THERAPEUTIC AMIDES ALLERGAN, INC. 2008-05-22 US disclosed
US-20080027108-A1 THERAPEUTIC SUBSTITUTED LACTAMS ALLERGAN, INC. 2008-01-31 US disclosed