SCHEMBL9303595

SCHEMBL9303595

CN(C(=O)c1cccc2ccccc12)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.60
NR4A1 P22736 1/20 0.56
NR4A2 P43354 1/20 0.56
NR4A3 Q92570 1/20 0.56
MAOB P27338 1/20 0.52
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
CDC25B P30305 1/20 0.50
PLK1 P53350 1/20 0.50
SIGMAR1 Q99720 3/20 0.49
KDM4E B2RXH2 1/20 0.47
MMP3 P08254 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
PLAU P00749 1/20 0.47
PTPN1 P18031 1/20 0.46
MAPT P10636 1/20 0.45
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 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
SCHEMBL9001638 0.83 POLB (0.75) POLBMAOBKMT2AKDM4EHTT
SCHEMBL9548533 0.82 NR4A1 (0.60) NR4A1NR4A2NR4A3KMT2AMEN1
SCHEMBL10969110 0.82 LDHA (0.60) POLBMAOBKMT2AMEN1PLAU
SCHEMBL10407111 0.82 NR4A1 (0.59) POLBNR4A1NR4A2NR4A3KMT2A
SCHEMBL11833560 0.81 NR4A1 (0.58) NR4A1NR4A2NR4A3KMT2AMEN1
Hydrochloric Acid SCHEMBL11683665 0.79 NR4A1 (0.56) POLBNR4A1NR4A2NR4A3KMT2A
Hydrochloric Acid SCHEMBL11865419 0.79 NR4A1 (0.56) NR4A1NR4A2NR4A3KMT2AMEN1
SCHEMBL29009647 0.78 SIGMAR1 (0.46) POLBNR4A1NR4A2NR4A3KMT2A
SCHEMBL3792155 0.77 NR4A1 (0.53) POLBNR4A1NR4A2NR4A3KMT2A
SCHEMBL31060098 0.77 NR4A1 (0.53) POLBNR4A1NR4A2NR4A3KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8410303-B2 Direct conversion of phenols into amides and esters of benzoic acid The Florida State University Research Foundation, Inc. (US) 2013-04-02 US disclosed
US-5278315-A Phenylaminonaphthalyl hydrazone IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-01-11 US disclosed