SCHEMBL17898406

SCHEMBL17898406

c1ccc(-n2c3ccccc3c3c(-n4c5ccc6ccccc6c5c5c6c7c8ccccc8ccc7n(-c7cccc8c7c7ccccc7n8-c7ccccc7)c6ccc54)cccc32)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.49
KDM4E B2RXH2 1/20 0.49
ATM Q13315 1/20 0.49
ALDH1A1 P00352 3/20 0.36
TDP1 Q9NUW8 1/20 0.36
SIGMAR1 Q99720 1/20 0.35
JAK2 O60674 1/20 0.34
JAK3 P52333 1/20 0.34
MAPK8 P45983 2/20 0.33
KMT2A Q03164 2/20 0.33
IL1R1 P14778 1/20 0.33
TSHR P16473 1/20 0.33
KDR P35968 1/20 0.32
MAPK9 P45984 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
PGR P06401 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL17990325 0.91 L3MBTL1 (0.52) L3MBTL1KDM4EATMALDH1A1SIGMAR1
SCHEMBL17989762 0.91 L3MBTL1 (0.59) L3MBTL1KDM4EATMALDH1A1TDP1
SCHEMBL19342683 0.91 L3MBTL1 (0.59) L3MBTL1KDM4EATMALDH1A1JAK2
SCHEMBL17245394 0.89 KDM4E (0.53) L3MBTL1KDM4EATMALDH1A1TDP1
SCHEMBL17990341 0.89 ATM (0.47) L3MBTL1KDM4EATMALDH1A1TDP1
SCHEMBL17898419 0.89 ATM (0.50) L3MBTL1KDM4EATMALDH1A1TDP1
SCHEMBL17990351 0.88 KDM4E (0.42) L3MBTL1KDM4EATMALDH1A1TDP1
SCHEMBL18126079 0.88 L3MBTL1 (0.60) L3MBTL1KDM4EATMALDH1A1JAK2
SCHEMBL19769545 0.87 KDM4E (0.45) L3MBTL1KDM4EATMALDH1A1SIGMAR1
SCHEMBL13086818 0.86 L3MBTL1 (0.57) L3MBTL1KDM4EATMALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160197282-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, LIGHT EMITTING DEVICE, LIGHTING DEVICE, DISPLAY DEVICE AND ELECTRONIC DEVICE Konica Minolta, Inc. (JP) 2016-07-07 US disclosed