SCHEMBL2730962

SCHEMBL2730962

[C]OCCC

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
SCHEMBL454777 0.77
SCHEMBL29937226 0.77
SCHEMBL29765248 0.72 THRB (0.50)
SCHEMBL30782966 0.72 THRB (0.50)
SCHEMBL31490901 0.67
SCHEMBL1101395 0.67
SCHEMBL7415141 0.67
SCHEMBL8755245 0.64
Hydrochloric Acid SCHEMBL6437470 0.64
Hydrochloric Acid SCHEMBL6439762 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6432995-B1 None US claimed
US-6432995-B2 INHIBIT THE RELEASE OF INFLAMMATORY CYTOKINES SUCH AS INTERLEUKIN-1 AND TUMOR NECROSIS FACTOR FROM CELLS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. 2002-08-13 US claimed
EP-0214093-B1 REACTIVE DYES, THEIR PREPARATION AND THEIR USE CIBA-GEIGY AG (CH) 1990-01-03 EP claimed
EP-0317845-A2 Substituted hydroxyl amines BAYER AG (DE) 1989-05-31 EP claimed
US-4785002-A Imidazo-pyrrolo-pyridines useful as fungicidal and growth-regulating agents BAYER AKTIENGESELLSCHAFT (DE) 1988-11-15 US claimed
US-8772313-B2 Benzenesulfonyl or sulfonamide compounds suitable for treating disorders that respond to the modulation of the serotonin 5-HT6 receptor ABBOTT LABORATORIES (US) 2014-07-08 US disclosed
EP-1767564-B2 POLYMER, A METHOD FOR PRODUCING THE POLYMER, AND A CEMENT ADMIXTURE USING THE SAME NIPPON CATALYTIC CHEM IND (JP) 2013-09-25 EP disclosed
US-20120129883-A1 BENZENESULFONYL OR SULFONAMIDE COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO THE MODULATION OFTHE SEROTONIN 5-HT6 RECEPTOR ABBOTT LABORATORIES (US) 2012-05-24 US disclosed
WO-2012059431-A1 BENZENESULFONYL OR SULFONAMIDE COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO THE MODULATION OF THE SEROTONIN 5-HT6 RECEPTOR ABBOTT GMBH & CO. KG (DE) 2012-05-10 WO disclosed
US-20100105636-A1 T-TYPE CALCIUM CHANNEL BLOCKER NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-04-29 US disclosed
EP-1767564-B1 Polymer, a method for producing the polymer, and a cement admixture using the same NIPPON CATALYTIC CHEM IND (JP) 2009-11-11 EP disclosed
US-20070129335-A1 T-type calcium channel blocker NISSAN CHEMICAL INDUSTRIES, LTD (JP) 2007-06-07 US disclosed
EP-0382687-A2 Benzofused-N-containing heterocycle derivatives BOEHRINGER INGELHEIM ITALIA S.p.A. (IT) 1990-08-16 EP disclosed
EP-0369385-A2 Reactive dyes, their preparation and their use CIBA-GEIGY AG (CH) 1990-05-23 EP disclosed
EP-0344519-A1 Substituted 4-(quinolin-2-yl-methoxy)phenyl-acetic-acid derivatives BAYER AG (DE) 1989-12-06 EP disclosed
EP-0325130-A2 Substituted pyridines BAYER AG (DE) 1989-07-26 EP disclosed
EP-0317845-A2 Substituted hydroxyl amines BAYER AG (DE) 1989-05-31 EP disclosed
EP-0272534-A2 8-substituted 2-aminotetralins BAYER AG (DE) 1988-06-29 EP disclosed
EP-0253321-A2 Benzenesulfonamido-indanyl-compounds, medicines containing these compounds and process for their preparation Dr. Karl Thomae GmbH (DE) 1988-01-20 EP disclosed
EP-0058779-B1 CARBOXAMIDES, THEIR PREPARATION AND THEIR USE AS MEDICINES Dr. Karl Thomae GmbH (DE) 1984-09-19 EP disclosed