SCHEMBL2720194

SCHEMBL2720194

Cc1ccc(-c2cn(C(c3ccccc3)(c3ccccc3)c3ccccc3)c(I)n2)s1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.34
MAPT P10636 3/20 0.34
ALDH1A1 P00352 2/20 0.34
HSD17B10 Q99714 2/20 0.34
GFER P55789 1/20 0.34
RAB9A P51151 5/20 0.33
KDM4E B2RXH2 3/20 0.33
NFKB1 P19838 3/20 0.33
NFKB2 Q00653 3/20 0.33
RELA Q04206 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
TP53 P04637 2/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 2/20 0.33
ATM Q13315 1/20 0.33
PTGS2 P35354 1/20 0.33
POLB P06746 2/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
MEN1 O00255 1/20 0.31

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
SCHEMBL1423935 0.80 CYP11B1 (0.33)
SCHEMBL2719724 0.72 NPC1 (0.42) NPC1MAPTALDH1A1HSD17B10GFER
SCHEMBL16404273 0.71 POLB (0.42) NPC1MAPTALDH1A1HSD17B10GFER
SCHEMBL2717017 0.71 ENPP2 (0.43) NPC1MAPTALDH1A1HSD17B10GFER
SCHEMBL3854778 0.69 NPC1 (0.33) NPC1MAPTALDH1A1HSD17B10GFER
SCHEMBL8548870 0.67 NPSR1 (0.33)
SCHEMBL3500675 0.67 CYP11B1 (0.33)
SCHEMBL7588677 0.67 PTGS1 (0.41) MAPTALDH1A1HSD17B10KDM4ESMN1; SMN2
SCHEMBL8022922 0.67 NOTUM (0.36)
SCHEMBL8006029 0.67 P2RX7 (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8937303-B2 Organic electroluminescent device COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2015-01-20 US disclosed
US-8937303-B2 Organic electroluminescent device COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2015-01-20 US disclosed
CN-103370808-A Organic electroluminescent device COMMW SCIENT IND RES ORG 2013-10-23 CN disclosed
US-20130264554-A1 ORGANIC ELECTROLUMINESCENT DEVICE COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2013-10-10 US disclosed
EP-2630682-A1 ORGANIC ELECTROLUMINESCENT DEVICE Commonwealth Scientific & Industrial Research Organisation ( C.S.I.R.O. ) (AU) 2013-08-28 EP disclosed
WO-2012051667-A1 ORGANIC ELECTROLUMINESCENT DEVICE COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2012-04-26 WO disclosed
WO-2012051667-A1 ORGANIC ELECTROLUMINESCENT DEVICE COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2012-04-26 WO disclosed