SCHEMBL722165

SCHEMBL722165

NC(=O)c1c(-c2ccccc2)ccc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 2/20 0.47
KDM4E B2RXH2 5/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
HPGD P15428 3/20 0.44
CYP1A2 P05177 2/20 0.44
ALDH1A1 P00352 2/20 0.44
GLA P06280 2/20 0.44
HSD17B10 Q99714 2/20 0.44
CYP2C19 P33261 1/20 0.44
MAPT P10636 4/20 0.43
TDP1 Q9NUW8 3/20 0.43
HTT P42858 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CYP1A1 P04798 1/20 0.43
CYP1B1 Q16678 1/20 0.43
GAA P10253 2/20 0.42
NPC1 O15118 1/20 0.42
PABPC1 P11940 1/20 0.42

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
SCHEMBL9053835 0.93 BCAT2 (0.49) BCAT2KDM4EMEN1KMT2AHPGD
SCHEMBL7787418 0.89 HDAC8 (0.43) KDM4EMEN1KMT2AHPGDCYP1A2
SCHEMBL3791252 0.86 KDM4E (0.40) BCAT2KDM4EMEN1KMT2AHPGD
SCHEMBL4856686 0.85 MEN1 (0.49) KDM4EMEN1KMT2AHPGDCYP1A2
SCHEMBL1195261 0.85 MEN1 (0.57) KDM4EMEN1KMT2AHPGDCYP1A2
SCHEMBL7325294 0.85 KMO (0.49) KDM4EMEN1KMT2AHPGDCYP1A2
SCHEMBL28539802 0.85 KDM4E (0.51) BCAT2KDM4EMEN1KMT2AHPGD
SCHEMBL28928988 0.82 MEN1 (0.46) KDM4EMEN1KMT2AHPGDCYP1A2
SCHEMBL20547797 0.80 KDM1A (0.50) KDM4EHPGDCYP1A2HSD17B10CYP2C19
SCHEMBL23499962 0.78 NSD2 (0.46) KDM4EMEN1KMT2AHPGDCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110483582-A Azepine Cabbeen palladium complex crystal and its synthetic method and preparing the application in amide compound UNIV SHAANXI NORMAL 2019-11-22 CN disclosed
CN-104829542-B Aniline pyrimidine class compound, its preparation method and medical usage 中国科学院上海药物研究所 2018-02-02 CN disclosed
CN-104860885-B Naphthoyl aminated compounds, preparation method and use 中国科学院上海药物研究所 2017-11-17 CN disclosed
US-8227387-B2 Metalworking oil composition NIPPON OIL CORPORATION (JP) 2012-07-24 US disclosed
US-20120053097-A1 Metal working oil composition NIPPON OIL CORPORATION 2012-03-01 US disclosed
CN-1150281-C Azo compounds and process for preparing the same ��ʽ������Ұ��ҩӦ���о��� 2004-05-19 CN disclosed