SCHEMBL20107564

SCHEMBL20107564

CC(C)(C)OC(=O)NCOC(=O)c1cc(N)cc(N)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 2/20 0.47
NPC1 O15118 1/20 0.40
ADRB2 P07550 3/20 0.37
ADRB1 P08588 3/20 0.37
ADRB3 P13945 3/20 0.37
KDM4A O75164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CA12 O43570 4/20 0.36
CA1 P00915 4/20 0.36
CA2 P00918 4/20 0.36
CA9 Q16790 4/20 0.36
MAOA P21397 2/20 0.35
MAOB P27338 1/20 0.35
IDO1 P14902 1/20 0.35
AAK1 Q2M2I8 1/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL28210978 0.81 SERPINE1 (0.45) SERPINE1NPC1ADRB2ADRB1ADRB3
SCHEMBL7430220 0.79 SYK (0.49) SERPINE1NPC1ADRB2ADRB1ADRB3
SCHEMBL1278770 0.77 CA12 (0.45) SERPINE1NPC1CA12CA1CA2
SCHEMBL8129924 0.76 HDAC1 (0.40) SERPINE1KDM4ACA1CA2GAA
SCHEMBL31246004 0.75 TDP1 (0.49) TDP1CA12CA1CA2CA9
SCHEMBL21448062 0.75 KDM4A (0.46) KDM4ATDP1CA12CA1CA2
SCHEMBL20758236 0.75 CSNK1D (0.45) TDP1CA12CA1CA2CA9
SCHEMBL8122251 0.73 CA12 (0.45) SERPINE1NPC1CA12CA1CA2
SCHEMBL22840821 0.73 NPC1 (0.46) SERPINE1NPC1CA12CA1CA2
SCHEMBL21637520 0.73 TDP1 (0.47) TDP1CA12CA1CA2CA9

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
US-20210355279-A1 Polyimides FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. 2021-11-18 US disclosed
US-20200262978-A1 Polyimides FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. 2020-08-20 US disclosed
WO-2018080870-A1 POLYIMIDES FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2018-05-03 WO disclosed