SCHEMBL3683716

SCHEMBL3683716

O=C(CC1CCCC(CC(=O)c2ccccc2)N1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.51
ALDH1A1 P00352 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
KCNH2 Q12809 1/20 0.47
CYP2D6 P10635 4/20 0.46
CYP1A2 P05177 2/20 0.46
TSHR P16473 1/20 0.46
NFKB1 P19838 1/20 0.46
LMNA P02545 1/20 0.46
CHRNB2 P17787 1/20 0.46
HTR2A P28223 1/20 0.46
HRH1 P35367 1/20 0.46
CHRNA7 P36544 1/20 0.46
CHRNA4 P43681 1/20 0.46
SLC18A2 Q05940 1/20 0.46
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.45
CYP3A4 P08684 1/20 0.45
HPGD P15428 1/20 0.45

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
SCHEMBL14208954 1.00 MAPT (0.51) MAPTALDH1A1L3MBTL1KCNH2CYP2D6
SCHEMBL14178966 1.00 MAPT (0.51) MAPTALDH1A1L3MBTL1KCNH2CYP2D6
SCHEMBL12215138 0.86 CYP2D6 (0.60) MAPTALDH1A1L3MBTL1KCNH2CYP2D6
SCHEMBL11343167 0.83 KHK (0.52) MAPTALDH1A1L3MBTL1KCNH2KMT2A
SCHEMBL16057529 0.83 KCNH2 (0.46) MAPTALDH1A1L3MBTL1KCNH2TDP1
SCHEMBL7860033 0.81 POLB (0.54) MAPTALDH1A1L3MBTL1KMT2A
SCHEMBL8980360 0.81 MAPT (0.44) MAPTALDH1A1L3MBTL1KCNH2CYP2D6
SCHEMBL28315342 0.81 MAPT (0.44) MAPTALDH1A1L3MBTL1KCNH2CYP2D6
SCHEMBL6845223 0.79 ALDH1A1 (0.51) MAPTALDH1A1L3MBTL1CYP2D6CYP1A2
SCHEMBL252506 0.79 ALDH1A1 (0.51) MAPTALDH1A1L3MBTL1CYP2D6CYP1A2

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106389788-B It is a kind of for enhancing the drug extract, preparation and preparation method of immunologic function of livestock and birds and anti-virus ability 青岛农业大学 2019-09-13 CN disclosed
CN-108272884-A Treat the pharmaceutical composition and preparation method thereof of hepatitis B 王宏奎 2018-07-13 CN disclosed
CN-107648516-A A kind of Chinese medicine for treating the chronic NUG of damp heat downward flowing type and preparation method thereof 河南中医药大学 2018-02-02 CN disclosed
CN-106728694-A A kind of tumor post-operation patients ' recovery Chinese medicine preparation and preparation method thereof 广州华河科技有限公司 2017-05-31 CN disclosed
CN-106389788-A Medicine extract for strengthening anti-virus capability and immune function of livestock, preparation, and preparation method 青岛农业大学 2017-02-15 CN disclosed
CN-105902862-A Traditional Chinese medicine composition for treating deinagkistrodon acutus bites 三江县连兴蛇业有限公司 2016-08-31 CN disclosed
CN-105902622-A Drug for treating deinagkistrodon acutus bites 三江县连兴蛇业有限公司 2016-08-31 CN disclosed
CN-105748978-A Wind-dispelling and heat-clearing preparation for mainly treating epistaxis and preparation method 商孝霞 2016-07-13 CN disclosed
CN-105561014-A Traditional Chinese medicine for treating epistaxis and preparation method SHANG XIAOXIA 2016-05-11 CN disclosed
CN-105311335-A Traditional Chinese medicine composition for assisting tumor chemoradiotherapy LU ZHONGXIN 2016-02-10 CN disclosed
CN-1232270-C A Chinese medicinal composition for treating hepatocarcinoma and pancreatic cancer, and its preparation method LI JIANYONG (CN) 2005-12-21 CN disclosed
CN-1187081-C Traditional Chinese medicine for treating lymph node relation type cancer LI JIANYONG (CN) 2005-02-02 CN disclosed
CN-1569081-A Antivirus Chinese traditional medicine and its preparation method LUO SIGAO (CN) 2005-01-26 CN disclosed
CN-1180815-C Tumor treating medicine 于玺长 2004-12-22 CN disclosed
CN-1491671-A A Chinese medicinal composition for treating hepatocarcinoma and pancreatic cancer, and its preparation method 李健勇 2004-04-28 CN disclosed
CN-1449812-A Chinese herbal compound for treating extensive cancers LI JIANYONG (CN) 2003-10-22 CN disclosed
CN-1383856-A Tumor treating medicine YU XICHANG (CN) 2002-12-11 CN disclosed
US-6346547-B1 TREATING ATHEROSCLEROSIS, RESTENOSIS AND STROKE CHECKPOINT, GENETICS, INC. 2002-02-12 US disclosed
EP-1153010-A1 $i(N)-SUBSTITUTED AMINO ACIDS, ANTIOXIDANT PHARMACEUTICAL COMPOSITIONS CONTAINING SAME AND METHODS USING SAME Checkpoint Genetics, Inc. (US) 2001-11-14 EP disclosed
WO-2000046183-A1 N-SUBSTITUTED AMINO ACIDS, ANTIOXIDANT PHARMACEUTICAL COMPOSITIONS CONTAINING SAME AND METHODS USING SAME CHECKPOINT GENETICS, INC. (US) 2000-08-10 WO disclosed