SCHEMBL16472889

SCHEMBL16472889

c1cncc(-c2cc3cc4sccc4cc3c3cc4oc5ccccc5c4cc23)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 4/20 0.43
GRM4 Q14833 2/20 0.37
KDM4E B2RXH2 4/20 0.37
MAPT P10636 4/20 0.37
HSD17B10 Q99714 4/20 0.37
ALDH1A1 P00352 3/20 0.37
HPGD P15428 3/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
CYP11B2 P19099 3/20 0.36
GPR84 Q9NQS5 1/20 0.36
CYP2A6 P11509 2/20 0.36
HIPK2 Q9H2X6 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
GAA P10253 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35

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
SCHEMBL14725726 0.89 CYP11B1 (0.54) CYP11B1KDM4EMAPTHSD17B10ALDH1A1
SCHEMBL16472813 0.87 CYP11B1 (0.54) CYP11B1KDM4EMAPTHSD17B10ALDH1A1
SCHEMBL16472934 0.85 CYP11B1 (0.45) CYP11B1KDM4EMAPTHSD17B10ALDH1A1
SCHEMBL16472882 0.85 MAOA (0.35) GRM4KDM4EMAPTALDH1A1HPGD
SCHEMBL14725716 0.84 CYP11B1 (0.47) CYP11B1KDM4EMAPTHSD17B10ALDH1A1
SCHEMBL16472885 0.83 CYP11B1 (0.43) CYP11B1GRM4KDM4EMAPTHSD17B10
SCHEMBL16472863 0.82 CYP11B1 (0.46) CYP11B1NPC1RAB9ACYP11B2GPR84
SCHEMBL16472682 0.82 CYP11B1 (0.46) CYP11B1KDM4EMAPTHSD17B10ALDH1A1
SCHEMBL16472832 0.81 CYP11B1 (0.45) CYP11B1KDM4EMAPTHSD17B10ALDH1A1
SCHEMBL16472878 0.80 KDM4E (0.39) KDM4EMAPTHSD17B10ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9118021-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2015-08-25 US disclosed
US-9118021-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2015-08-25 US disclosed
US-20140103300-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-04-17 US disclosed
US-20140103300-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-04-17 US disclosed