SCHEMBL1963283

SCHEMBL1963283

c1cc(-c2nc[nH]n2)nc(-c2nc[nH]n2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.38
KDM4E B2RXH2 4/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
ALPL P05186 2/20 0.38
ALOX15 P16050 2/20 0.38
CCR1 P32246 2/20 0.38
CCR8 P51685 2/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
HSP90AA1 P07900 1/20 0.38
ALPI P09923 1/20 0.38
ALPG P10696 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
CCR5 P51681 1/20 0.38
RAB9A P51151 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
HSD17B10 Q99714 2/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL22053002 0.88 HTR7 (0.34) TDP1KDM4EL3MBTL1SMN1; SMN2ALPL
SCHEMBL28479920 0.83 NPC1 (0.49) TDP1KDM4EL3MBTL1SMN1; SMN2ALPL
SCHEMBL31345430 0.82 CTSS (0.41)
SCHEMBL2816133 0.78 KDM4E (0.56) TDP1KDM4EL3MBTL1SMN1; SMN2ALPL
SCHEMBL8731856 0.77 RAB9A (0.45) TDP1KDM4ESMN1; SMN2ALOX15LMNA
SCHEMBL150058 0.71
SCHEMBL2655553 0.70 NPC1 (0.46) KDM4EL3MBTL1SMN1; SMN2ALOX15MAPK1
SCHEMBL10896312 0.70 NISCH (0.41) TDP1KDM4EL3MBTL1SMN1; SMN2ALPL
SCHEMBL10759273 0.69 CLK4 (0.32)
SCHEMBL155254 0.67 METAP2 (0.36) TDP1KDM4ELMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2681228-B1 PLATINUM COMPLEXES AND THEIR USE Westfälische Wilhelms-Universität Münster (DE) 2016-12-21 EP disclosed
US-20130004986-A1 Use of luminescent Ir(III) and Ru(II) complexes WESTFAELISCHE WILHELMS-UNIVERITAET MUENSTER (DE) 2013-01-03 US disclosed
EP-2507339-A1 USE OF LUMINESCENT IR(III) AND RU(II) COMPLEXES Westfälische Wilhelms-Universität Münster (DE) 2012-10-10 EP disclosed
WO-2011067401-A1 USE OF LUMINESCENT IR(III) AND RU(II) COMPLEXES Westfälische Wilhelms-Universität Münster (DE) 2011-06-09 WO disclosed