SCHEMBL2086503

SCHEMBL2086503

c1cc(-c2c[nH]nn2)nnn1

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
SCHEMBL5397948 0.85
SCHEMBL11353371 0.83
SCHEMBL379708 0.79 KDM4E (0.32)
Charcoal, Activated SCHEMBL30558882 0.77 KDM4E (0.31)
SCHEMBL87533 0.76
SCHEMBL13931019 0.75 KDM4E (0.35)
SCHEMBL6050863 0.72
SCHEMBL399535 0.71
SCHEMBL9221257 0.69 CCNT1 (0.39)
SCHEMBL20523585 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7015222-B1 Agricultural compositions THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2006-03-21 US claimed
US-9812315-B2 Treating solution for electronic parts, and process for producing electronic parts FINE POLYMERS CORPORATION (JP) 2017-11-07 US disclosed
US-20150279654-A1 TREATING SOLUTION FOR ELECTRONIC PARTS, AND PROCESS FOR PRODUCING ELECTRONIC PARTS FINE POLYMERS CORPORATION (JP) 2015-10-01 US disclosed
EP-1907389-B1 PROCESS FOR PREPARING TRIAZOLE SUBSTITUTED AZAINDOLEOXOACETIC PIPERAZINE DERIVATIVES AND NOVEL SALT FORMS PRODUCED THEREIN BRISTOL MYERS SQUIBB CO (US) 2011-07-27 EP disclosed
US-7968718-B2 Process for preparing triazole substituted azaindoleoxoacetic piperazine derivatives and novel salt forms produced therein BRISTOL-MYERS SQUIBB COMPANY (US) 2011-06-28 US disclosed
US-20100076191-A1 PROCESS FOR PREPARING TRIAZOLE SUBSTITUTED AZAINDOLEOXOACETIC PIPERAZINE DERIVATIVES AND NOVEL SALT FORMS PRODUCED THEREIN BRISTOL-MYERS SQUIBB COMPANY 2010-03-25 US disclosed
US-7601715-B2 Process for preparing triazole substituted azaindoleoxoacetic piperazine derivatives and novel salt forms produced therein BRISTOL-MYERS SQUIBB COMPANY (US) 2009-10-13 US disclosed
EP-1907389-A2 PROCESS FOR PREPARING TRIAZOLE SUBSTITUTED AZAINDOLEOXOACETIC PIPERAZINE DERIVATIVES AND NOVEL SALT FORMS PRODUCED THEREIN Bristol-Myers Squibb Company (US) 2008-04-09 EP disclosed
WO-2007002308-A9 PROCESS FOR PREPARING TRIAZOLE SUBSTITUTED AZAINDOLEOXOACETIC PIPERAZINE DERIVATIVES AND NOVEL SALT FORMS PRODUCED THEREIN BRISTOL MYERS SQUIBB CO (US) 2007-03-01 WO disclosed
WO-2007002308-A2 PROCESS FOR PREPARING TRIAZOLE SUBSTITUTED AZAINDOLEOXOACETIC PIPERAZINE DERIVATIVES AND NOVEL SALT FORMS PRODUCED THEREIN BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-04 WO disclosed
US-20060293304-A1 Process for preparing triazole substituted azaindoleoxoacetic piperazine derivatives and novel salt forms produced therein BRISTOL-MYERS SQUIBB COMPANY 2006-12-28 US disclosed
US-7015222-B1 Agricultural compositions THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2006-03-21 US disclosed