SCHEMBL3318012

SCHEMBL3318012

C=COC(=O)C(=CC)c1cccc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.46
NR4A2 P43354 1/20 0.46
NR4A3 Q92570 1/20 0.46
PLK1 P53350 1/20 0.45
AKR1C2 P52895 1/20 0.43
CYP1A2 P05177 3/20 0.43
CYP3A4 P08684 3/20 0.43
CYP2D6 P10635 3/20 0.43
CYP2C9 P11712 3/20 0.43
CYP2C19 P33261 2/20 0.43
MMP3 P08254 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
KMT2A Q03164 5/20 0.42
CDC25B P30305 2/20 0.41
PTPN1 P18031 1/20 0.41
PTK2B Q14289 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 4/20 0.40
POLB P06746 3/20 0.40
KDM4E B2RXH2 3/20 0.40

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
SCHEMBL78737 0.85 NR4A1 (0.44) NR4A1NR4A2NR4A3PLK1AKR1C2
SCHEMBL1338804 0.83 PLK1 (0.53) NR4A1NR4A2NR4A3PLK1AKR1C2
SCHEMBL28232823 0.83 PLK1 (0.53) NR4A1NR4A2NR4A3PLK1AKR1C2
SCHEMBL76920 0.81 NR4A1 (0.49) NR4A1NR4A2NR4A3PLK1CYP1A2
SCHEMBL4179299 0.79 NR4A1 (0.53) NR4A1NR4A2NR4A3PLK1MMP3
SCHEMBL7278141 0.79 CDC25B (0.58) NR4A1NR4A2NR4A3PLK1CYP1A2
SCHEMBL11581051 0.79 CDC25B (0.58) NR4A1NR4A2NR4A3PLK1CYP1A2
SCHEMBL27484086 0.78 NR4A1 (0.52) NR4A1NR4A2NR4A3PLK1MMP3
SCHEMBL11127311 0.77 CYP1A2 (0.60) NR4A1NR4A2NR4A3PLK1AKR1C2
SCHEMBL30507856 0.77 CYP1A2 (0.60) NR4A1NR4A2NR4A3PLK1AKR1C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110350151-A Protective coating and its manufacturing method containing lithium electrode 通用汽车环球科技运作有限责任公司 2019-10-18 CN disclosed
US-9163163-B2 Multilayer film, method for manufacture thereof and articles including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-10-20 US disclosed
US-20100112270-A1 MULTILAYER FILM, METHOD FOR MANUFACTURE THEREOF AND ARTICLES INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2010-05-06 US disclosed