SCHEMBL1621874

SCHEMBL1621874

C1=CCN2N=NSC2=C1

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
Water SCHEMBL8722470 0.60
SCHEMBL4503001 0.60
SCHEMBL1764386 0.58
SCHEMBL11103519 0.55
SCHEMBL7470268 0.54
SCHEMBL1266827 0.54
SCHEMBL3341420 0.52
SCHEMBL5075181 0.52
SCHEMBL17959075 0.52
SCHEMBL15758640 0.51

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210380620-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-12-09 US claimed
US-20210380620-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-12-09 US disclosed
US-9388346-B2 Removal of heteroaromatic sulfides from hydrocarbons using polyoxometalates catalysts YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2016-07-12 US disclosed
EP-2635658-A1 REMOVAL OF HETEROAROMATIC SULFIDES FROM HYDROCARBONS USING POLYOXOMETALATES CATALYSTS Yeda Research and Development Co. Ltd. (IL) 2013-09-11 EP disclosed
US-20130206646-A1 REMOVAL OF HETEROAROMATIC SULFIDES FROM HYDROCARBONS USING POLYOXOMETALATES CATALYSTS YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 2013-08-15 US disclosed
EP-2183232-B1 PI3 KINASE MODULATORS AND METHODS OF USE AMGEN INC (US) 2013-03-06 EP disclosed
WO-2012059914-A1 REMOVAL OF HETEROAROMATIC SULFIDES FROM HYDROCARBONS USING POLYOXOMETALATES CATALYSTS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2012-05-10 WO disclosed
US-7928140-B2 Benzothiazole PI3 kinase modulators for cancer treatment AMGEN INC. (US) 2011-04-19 US disclosed
EP-2183232-A2 PI3 KINASE MODULATORS AND METHODS OF USE Amgen, Inc (US) 2010-05-12 EP disclosed
US-20090054405-A1 PI3 kinase modulators and methods of use AMGEN INC. (US) 2009-02-26 US disclosed
WO-2009017822-A2 PI3 KINASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2009-02-05 WO disclosed