SCHEMBL27799525

SCHEMBL27799525

O=C(C1(c2cccc3ccccc23)C=CC=N1)C1(c2cccc3ccccc23)C=CC=N1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
MAPT P10636 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KDM4E B2RXH2 2/20 0.37
MAPK1 P28482 1/20 0.37
GAA P10253 1/20 0.37
NR4A1 P22736 1/20 0.36
NR4A2 P43354 1/20 0.36
NR4A3 Q92570 1/20 0.36
KIF11 P52732 2/20 0.34
MMP3 P08254 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
SLC6A3 Q01959 2/20 0.33
CBX7 O95931 1/20 0.33
CDY1; CDY1B Q9Y6F8 1/20 0.33
SIRT2 Q8IXJ6 1/20 0.33
SIRT1 Q96EB6 1/20 0.33
SIRT3 Q9NTG7 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
SCHEMBL28429659 0.74 ALDH1A1 (0.37) MEN1KMT2AKDM4EMAPK1GAA
SCHEMBL27832761 0.70
SCHEMBL28041241 0.69 MEN1 (0.41) MEN1KMT2AMAPTNPSR1KDM4E
SCHEMBL27946128 0.67 KDM4E (0.35) MEN1KMT2AMAPTKDM4EMAPK1
SCHEMBL21616816 0.64 KDM4E (0.33) MEN1KMT2AMAPTKDM4EMAPK1
SCHEMBL697151 0.61 AKR1C1 (0.48) MEN1KMT2AMAPTNPSR1KDM4E
SCHEMBL28240863 0.60 MEN1 (0.53) MEN1KMT2AMAPTKDM4EMAPK1
SCHEMBL8112531 0.60 AKR1C1 (0.52) NR4A1NR4A2NR4A3KIF11TDP1
SCHEMBL8747018 0.60 SLC6A3 (0.42) MEN1KMT2AMAPTNPSR1KDM4E
SCHEMBL3677596 0.60 KMT2A (0.41) MEN1KMT2AMAPTNPSR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110193033-A A kind of drug and its preparation method and application for treating diabete peripheral herve pathology 郑州工业应用技术学院 2019-09-03 CN disclosed
CN-205563340-U Cassia seed extract product technology monitoring instrument 西安源森生物科技有限公司 2016-09-07 CN disclosed
CN-102716182-B A kind of be used for the treatment of non-alcoholic fatty liver disease Semen Cassiae extract, preparation method and pharmacy application thereof CHONGQING ACADEMY OF CHINESE MATERIA MEDICA (CN) 2015-10-28 CN disclosed
CN-102716182-B A kind of be used for the treatment of non-alcoholic fatty liver disease Semen Cassiae extract, preparation method and pharmacy application thereof CHONGQING ACADEMY OF CHINESE MATERIA MEDICA (CN) 2015-10-28 CN disclosed
CN-104940278-A Application of cassia seed extract with effect of reducing blood fat in preparation of blood fat reducing medicaments and health foods UNIV ZHEJIANG CHINESE MEDICAL 2015-09-30 CN disclosed
CN-102716182-A Semen cassiae extract for treating nonalcoholic fatty liver diseases as well as preparation method and application of semen cassiae extract CHONGQING ACADEMY CHINESE MED 2012-10-10 CN disclosed
CN-101690795-B Tianshen vessel-freeing granules for treating cardiovascular and cerebrovascular diseases Weihai dongbao pharmaceutical co ltd 2012-08-08 CN disclosed
CN-101690795-A Tianshen vessel-freeing granules for treating cardiovascular and cerebrovascular diseases WEIHAI DONGBAO PHARMACEUTICAL 2010-04-07 CN disclosed