SCHEMBL19366336

SCHEMBL19366336

c1ccc(-c2nc(-c3ccc(-c4ccc(-c5nc(-c6ccccc6)nc(-n6c7ccccc7c7ccc8c9c%10ccccc%10ccc9n(-c9ccccc9)c8c76)n5)cc4)cc3)nc(-n3c4ccccc4c4ccc5c(ccc6c7ccccc7n(-c7ccccc7)c65)c43)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ATM Q13315 1/20 0.37
AVPR1A P37288 1/20 0.32
KMT2A Q03164 2/20 0.31
IL1R1 P14778 1/20 0.31
MAPT P10636 2/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
RECQL P46063 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PTGER4 P35408 1/20 0.31
PTGES O14684 1/20 0.31
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HTT P42858 1/20 0.30
ABCG2 Q9UNQ0 1/20 0.30

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
SCHEMBL13183577 0.97 L3MBTL1 (0.40) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL18057890 0.97 L3MBTL1 (0.40) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL17990507 0.93 L3MBTL1 (0.41) L3MBTL1KDM4EATMAVPR1AKMT2A
SCHEMBL17245557 0.93 L3MBTL1 (0.41) L3MBTL1KDM4EATMAVPR1AKMT2A
SCHEMBL19507680 0.93 KDM4E (0.35) L3MBTL1KDM4EATMKMT2ASMN1; SMN2
SCHEMBL12691001 0.92 RAB9A (0.35) L3MBTL1KDM4EATMAVPR1AKMT2A
SCHEMBL8818627 0.91 KDM4E (0.35) L3MBTL1KDM4EATMAVPR1AKMT2A
SCHEMBL12691518 0.91 L3MBTL1 (0.39) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL21965171 0.90 PTGER4 (0.35) L3MBTL1KDM4EATMKMT2ANPC1
SCHEMBL20315595 0.89 L3MBTL1 (0.39) L3MBTL1KDM4EATMAVPR1AKMT2A

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-9768392-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2017-09-19 US disclosed