Benzene

Benzene

SCHEMBL740866

O=C=NCN=C=O.c1ccccc1.c1ccccc1

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

⚠ 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
Benzene SCHEMBL19066305 1.00
Benzene SCHEMBL21082728 1.00
SCHEMBL8399905 0.89 TSHR (0.33)
SCHEMBL21631 0.89
Fluoride SCHEMBL28770594 0.85
Charcoal, Activated SCHEMBL31121667 0.85
Ammonia Solution, Strong SCHEMBL5327532 0.85
Biphenyl SCHEMBL15542 0.84 ALDH1A1 (0.45)
Hydrazine SCHEMBL28643751 0.81
Diphenylmethane SCHEMBL8938749 0.80 CALM1 (0.55)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5872203-A Polyurethane adhesive composition for bonding polymeric roofing materials to roof-deck substrates ADCO PRODUCTS, INC. (US) 1999-02-16 US claimed
EP-0764707-A2 Polyurethane adhesive composition for bonding polymeric roofing materials to roof-deck substrates ADCO PRODUCTS, INC. (US) 1997-03-26 EP claimed
EP-3284772-B1 THIOETHERS, METHODS FOR THEIR PREPARATION, AND COMPOSITIONS INCLUDING SUCH THIOETHERS PRC DESOTO INT INC (US) 2019-09-11 EP disclosed
EP-3284772-A1 THIOETHERS, METHODS FOR THEIR PREPARATION, AND COMPOSITIONS INCLUDING SUCH THIOETHERS PRC-DESOTO INTERNATIONAL, INC. (US) 2018-02-21 EP disclosed
EP-2285868-B1 THIOETHERS, METHODS FOR THEIR PREPARATION, AND COMPOSITIONS INCLUDING SUCH THIOETHERS PRC DESOTO INT INC (US) 2017-10-04 EP disclosed
EP-2148897-B1 SEALANT COMPOSITION COMPRISING POLYTHIOETHER PRC DESOTO INT INC (US) 2017-05-31 EP disclosed
US-8481627-B2 Thioethers, methods for their preparation, and compositions including such thioethers PRC DESOTO INTERNATIONAL, INC. (US) 2013-07-09 US disclosed
US-8466220-B2 Thioethers, methods for their preparation, and compositions including such thioethers PRC DeSoto International, Inc (US) 2013-06-18 US disclosed
US-8138273-B2 Compositions including a polythioether PRC DeSoto International, Inc (US) 2012-03-20 US disclosed
WO-2011126834-A2 THIOETHERS, METHODS FOR THEIR PREPARATION, AND COMPOSITIONS INCLUDING SUCH THIOETHERS PRC-DESOTO INTERNATIONAL, INC. (US) 2011-10-13 WO disclosed
US-20110092639-A1 Compositions Including a Polythioether PRC-DESOTO INTERNATIONAL, INC. (US) 2011-04-21 US disclosed
US-7875666-B2 Thioethers, methods for their preparation, and compositions including such thioethers PRC-DE SOTO INTERNATIONAL, INC. (US) 2011-01-25 US disclosed
US-20100184899-A1 THIOETHERS, METHODS FOR THEIR PREPARATION, AND COMPOSITIONS INCLUDING SUCH THIOETHERS PRC-DESOTO INTERNATIONAL, INC. (US) 2010-07-22 US disclosed
EP-2148897-A1 SEALANT COMPOSITION COMPRISING POLYTHIOETHER PRC-DESOTO INTERNATIONAL, INC. (US) 2010-02-03 EP disclosed
US-20090270554-A1 THIOETHERS, METHODS FOR THEIR PREPARATION, AND COMPOSITIONS INCLUDING SUCH THIOETHERS PRC-DESOTO INTERNATIONAL, INC. (US) 2009-10-29 US disclosed
WO-2009131796-A1 THIOETHERS, METHODS FOR THEIR PREPARATION, AND COMPOSITIONS INCLUDING SUCH THIOETHERS PRC-DESOTO INTERNATIONAL, INC. (US) 2009-10-29 WO disclosed
US-20090012244-A1 COMPOSITIONS INCLUDING A POLYTHIOETHER PRC-DESOTO INTERNATIONAL, INC. (US) 2009-01-08 US disclosed
WO-2008137198-A1 SEALANT COMPOSITION COMPRISING POLYTHIOETHER PRC-DESOTO INTERNATIONAL, INC. (US) 2008-11-13 WO disclosed
US-5872203-A Polyurethane adhesive composition for bonding polymeric roofing materials to roof-deck substrates ADCO PRODUCTS, INC. (US) 1999-02-16 US disclosed
EP-0764707-A2 Polyurethane adhesive composition for bonding polymeric roofing materials to roof-deck substrates ADCO PRODUCTS, INC. (US) 1997-03-26 EP disclosed