SCHEMBL23059656

SCHEMBL23059656

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc(CCCCCCCc5ccc(-c6nc(-c7ccccc7)nc(-c7ccc(-c8ccccc8)cc7)n6)cc5)cc4)n3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 2/20 0.51
HDAC1 Q13547 1/20 0.51
MAOB P27338 2/20 0.50
HSD11B1 P28845 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
RARB P10826 4/20 0.46
MEN1 O00255 3/20 0.46
ALDH1A1 P00352 3/20 0.46
MAPT P10636 3/20 0.46
KMT2A Q03164 3/20 0.46
RARA P10276 1/20 0.46
MTOR P42345 1/20 0.46
FFAR1 O14842 1/20 0.46
MGLL Q99685 1/20 0.45
FDFT1 P37268 1/20 0.45
HPGD P15428 2/20 0.44
SIGMAR1 Q99720 1/20 0.44
KDM4E B2RXH2 1/20 0.44
USP2 O75604 1/20 0.44
GAA P10253 1/20 0.44

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
SCHEMBL16152355 0.91 HSD11B1 (0.60) HSD11B1RARBMEN1ALDH1A1MAPT
SCHEMBL12628223 0.89 HSD11B1 (0.62) HSD11B1RARBMEN1ALDH1A1MAPT
SCHEMBL24372725 0.89 MAOB (0.44) HDAC2HDAC1MAOBHSD11B1L3MBTL1
SCHEMBL19784929 0.87 HSD11B1 (0.61) HSD11B1L3MBTL1RARBMEN1ALDH1A1
SCHEMBL30869989 0.85 HDAC2 (0.60) HDAC2HDAC1MAOBHSD11B1FFAR1
SCHEMBL24372546 0.85 L3MBTL1 (0.44) HDAC2MAOBHSD11B1L3MBTL1MEN1
SCHEMBL12460704 0.83 HSD11B1 (0.40) HDAC2HDAC1MAOBHSD11B1RARB
SCHEMBL12622306 0.82 ALDH1A1 (0.63) HSD11B1RARBMEN1ALDH1A1MAPT
SCHEMBL24372436 0.82 S1PR3 (0.55) HDAC2HDAC1
SCHEMBL3311898 0.82 HDAC2 (0.53) HDAC2HDAC1MAOBRARBMEN1

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-20210066618-A1 ORGANIC LIGHT-EMITTING DEVICE AND FLAT DISPLAY APPARATUS INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2021-03-04 US disclosed