SCHEMBL1683855

SCHEMBL1683855

[N]c1ccncc1

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
SCHEMBL3794394 0.69 — —
SCHEMBL6282891 0.69 — —
SCHEMBL9728 0.67 MAPT (1.00) —
SCHEMBL17310765 0.67 MAPT (0.67) —
Hydrogen Sulfide SCHEMBL3929756 0.64 MAPT (0.92) —
Hydrochloric Acid SCHEMBL5548691 0.64 MAPT (0.92) —
SCHEMBL135626 0.64 MAPT (0.92) —
Hydrochloric Acid SCHEMBL8372850 0.64 MAPT (0.92) —
SCHEMBL10000032 0.64 MAPT (0.92) —
Water SCHEMBL11112402 0.64 MAPT (0.92) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023107552-A2 PURINES AND METHODS OF THEIR USE Kineta, Inc. (US) 2023-06-15 — — WO claimed
US-20160060262-A1 Substituted 6,6-Fused Nitrogenous Heterocyclic Compounds and Uses Thereof GENENTECH, INC. (US) 2016-03-03 — — US claimed
EP-2516441-B1 PTERIDINONES AS INHIBITORS OF POLO-LIKE KINASE ELAN PHARM INC (US) 2015-01-21 — — EP claimed
US-20120322785-A1 SUBSTITUTED 6,6-FUSED NITROGENOUS HETEROCYCLIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2012-12-20 — — US claimed
WO-2023107552-A2 PURINES AND METHODS OF THEIR USE Kineta, Inc. (US) 2023-06-15 — — WO disclosed
US-20160060262-A1 Substituted 6,6-Fused Nitrogenous Heterocyclic Compounds and Uses Thereof GENENTECH, INC. (US) 2016-03-03 — — US disclosed
US-8623889-B2 Substituted 6,6-fused nitrogenous heterocyclic compounds and uses thereof GENENTECH, INC. (US) 2014-01-07 — — US disclosed
US-8530649-B2 Polymer complex THE UNIVERSITY OF TOKYO (JP) 2013-09-10 — — US disclosed
US-20120322785-A1 SUBSTITUTED 6,6-FUSED NITROGENOUS HETEROCYCLIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2012-12-20 — — US disclosed
US-20110098414-A1 Polymer Complex THE UNIVERSITY OF TOKYO (JP) 2011-04-28 — — US disclosed
EP-1630165-B1 [1,2,4]TRIAZOLO[1,5-a]PYRIMIDIN-2-YLUREA DERIVATIVE AND USE THEREOF NIPPON KAYAKU KK (JP) 2010-03-31 — — EP disclosed
US-7598244-B2 [1,2,4]triazolo[1,5,a]pyrimidin-2-ylurea derivative and use thereof NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-10-06 — — US disclosed
US-20070010515-A1 [1,2,4] Triazolo [1,5, a] pyrimidin-2-ylurea derivative and use thereof NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2007-01-11 — — US disclosed
EP-1630165-A1 [1,2,4 ]TRIAZOLO [1,5-A]PYRIMIDIN-2-YLUREA DERIVATIVE AND USE THEREOF Nippon Kayaku Kabushiki Kaisha (JP) 2006-03-01 — — EP disclosed
US-20050234094-A1 Inhibition of protein kinases with piridinylimidazoles SMITHKLINE BEECHAM P.L.C. 2005-10-20 — — US disclosed
EP-1076560-A1 INHIBITION OF PROTEIN KINASES WITH PIRIDINYLIMIDAZOLES SMITHKLINE BEECHAM PLC (GB) 2001-02-21 — — EP disclosed
WO-1999058128-A1 INHIBITION OF PROTEIN KINASES WITH PIRIDINYLIMIDAZOLES SMITHKLINE BEECHAM PLC (GB) 1999-11-18 — — WO disclosed
US-4980355-A Substituted isonicotinic acid amides; prevent attack by phytopathogenic fungi, bacteria and viruses CIBA-GEIGY CORPORATION (US) 1990-12-25 — — US disclosed
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