SCHEMBL536494

SCHEMBL536494

NC=C(N)C(C(N)=CN)C(N)=CN

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
SCHEMBL19227200 0.72
SCHEMBL21477587 0.69
SCHEMBL13935017 0.69
SCHEMBL10543015 0.67
SCHEMBL21311 0.61
Ammonia Solution, Strong SCHEMBL7559311 0.58
SCHEMBL3310527 0.58
Iodide SCHEMBL8346124 0.58
SCHEMBL21153213 0.58
Ammonia Solution, Strong SCHEMBL902203 0.58

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3841136-B1 CATALYST FOR PIR/PUR FOAM PRODUCTION HUNTSMAN INT LLC (US) 2024-06-19 EP disclosed
US-20240182627-A1 CATALYST FOR PIR/PUR FOAM PRODUCTION HUNTSMAN INTERNATIONAL LLC 2024-06-06 US disclosed
EP-2414423-B1 POLYURETHANE AND POLYISOCYANURATE FOAMS HAVING IMPROVED CURING PERFORMANCE AND FIRE BEHAVIOR DOW GLOBAL TECHNOLOGIES LLC (US) 2018-05-30 EP disclosed
WO-2017160361-A1 POLYISOCYANURATE CATALYSTS FOR METAL PANELS AND SPRAY FOAMS HUNTSMAN PETROCHEMICAL LLC (US) 2017-09-21 WO disclosed
WO-2017160362-A1 METAL SALTS OF AMINIO ACID TRIAZINES AS POLYURETHANE AND POLYISOCYANURATE CATALYSTS HUNTSMAN PETROCHEMICAL LLC (US) 2017-09-21 WO disclosed
EP-2652000-B1 POLYURETHANE AND POLYISOCYANURATE FOAMS DOW GLOBAL TECHNOLOGIES LLC (US) 2016-05-25 EP disclosed
US-20130251980-A1 POLYURETHANE AND POLYISOCYANURATE FOAMS DOW GLOBAL TECHNOLOGIES LLC (US) 2013-09-26 US disclosed
EP-2414423-A1 POLYURETHANE AND POLYISOCYANURATE FOAMS HAVING IMPROVED CURING PERFORMANCE AND FIRE BEHAVIOR Dow Global Technologies LLC (formerly Known As Dow Global Technologies Inc.) (US) 2012-02-08 EP disclosed
US-20120009414-A1 POLYURETHANE AND POLYISOCYANURATE FOAMS HAVING IMPROVED CURING PERFORMANCE AND FIRE BEHAVIOR DOW GLOBAL TECHNOLOGIES LLC (US) 2012-01-12 US disclosed
WO-2010114703-A1 POLYURETHANE AND POLYISOCYANURATE FOAMS HAVING IMPROVED CURING PERFORMANCE AND FIRE BEHAVIOR DOW GLOBAL TECHNOLOGIES INC. (US) 2010-10-07 WO disclosed