SCHEMBL18805391

SCHEMBL18805391

c1cc2nc3n(c2cc1N1CCCC1)c1nc2ccc(N4CCCC4)cc2n1c1nc2ccc(N4CCCC4)cc2n31

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TERT O14746 3/20 0.53
IP6K1 Q92551 3/20 0.44
MAP4K4 O95819 1/20 0.43
PDE3B Q13370 2/20 0.42
PDE3A Q14432 2/20 0.42
IP6K3 Q96PC2 1/20 0.42
HSD17B10 Q99714 2/20 0.41
ALDH1A1 P00352 3/20 0.41
S100B P04271 2/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 2/20 0.40
LMNA P02545 2/20 0.40
KMT2A Q03164 2/20 0.40
GAA P10253 1/20 0.40
PKM P14618 1/20 0.40
ALOX15 P16050 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL18805370 0.85 MAPT (0.51) PDE3BPDE3AALDH1A1MAPTMEN1
SCHEMBL971482 0.72 PSMB1 (0.45) TERTIP6K1MAP4K4PDE3BPDE3A
SCHEMBL29604278 0.68 GAA (0.71) TERTIP6K1MAP4K4IP6K3ALDH1A1
SCHEMBL5724657 0.68 TERT (0.61) TERTIP6K1MAP4K4PDE3BPDE3A
SCHEMBL18805371 0.67 IKBKB (0.49) ALDH1A1MAPTLMNAKMT2AGAA
SCHEMBL18805406 0.67 BIRC5 (0.50) TERTMAPT
SCHEMBL21279431 0.67 GAA (0.69) TERTIP6K1MAP4K4IP6K3ALDH1A1
SCHEMBL28874935 0.67 TERT (0.56) TERTIP6K1MAP4K4HSD17B10ALDH1A1
SCHEMBL2174173 0.66 ALDH1A1 (0.67) TERTHSD17B10ALDH1A1MAPTMEN1
SCHEMBL18493222 0.66 TERT (0.92) TERTIP6K1MAP4K4PDE3BPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170358767-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT Konica Minolta, Inc. (JP) 2017-12-14 US disclosed
US-20170358767-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT Konica Minolta, Inc. (JP) 2017-12-14 US disclosed
US-20170338446-A1 Organic Electroluminescence Element MERCK PATENT GMBH (DE) 2017-11-23 US disclosed
US-20170338446-A1 Organic Electroluminescence Element MERCK PATENT GMBH (DE) 2017-11-23 US disclosed
US-20170125715-A1 ORGANIC ELECTROLUMINESCENT ELEMENT Konica Minolta, Inc. (JP) 2017-05-04 US disclosed
US-20170125715-A1 ORGANIC ELECTROLUMINESCENT ELEMENT Konica Minolta, Inc. (JP) 2017-05-04 US disclosed