SCHEMBL17990519

SCHEMBL17990519

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5ccc6c7ccc8ccccc8c7n(-c7ccccc7)c6c54)cc3)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.44
ATM Q13315 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 2/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
RECQL P46063 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP1A1 P04798 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP1B1 Q16678 1/20 0.36
KMT2A Q03164 3/20 0.35
IL1R1 P14778 1/20 0.35
MEN1 O00255 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HTT P42858 1/20 0.35
ABCG2 Q9UNQ0 1/20 0.35
PDPK1 O15530 2/20 0.34
AVPR1A P37288 1/20 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
SCHEMBL13086799 0.96 L3MBTL1 (0.43) L3MBTL1ATMKDM4EMAPTNPC1
SCHEMBL17943425 0.95 L3MBTL1 (0.42) L3MBTL1ATMKDM4EMAPTNPC1
SCHEMBL21524323 0.95 L3MBTL1 (0.42) L3MBTL1ATMKDM4EMAPTNPC1
SCHEMBL17943405 0.95 L3MBTL1 (0.42) L3MBTL1ATMKDM4EMAPTNPC1
SCHEMBL17943440 0.95 L3MBTL1 (0.42) L3MBTL1ATMKDM4EMAPTNPC1
SCHEMBL25140465 0.95 L3MBTL1 (0.42) L3MBTL1ATMKDM4EMAPTNPC1
SCHEMBL12691506 0.93 MAPT (0.43) L3MBTL1ATMKDM4EMAPTNPC1
SCHEMBL17278464 0.93 L3MBTL1 (0.50) L3MBTL1ATMKDM4EMAPTKMT2A
SCHEMBL18057958 0.92 L3MBTL1 (0.44) L3MBTL1ATMKDM4EMAPTNPC1
SCHEMBL12691508 0.92 L3MBTL1 (0.44) L3MBTL1ATMKDM4EMAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 US disclosed
US-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 US disclosed