SCHEMBL8031376

SCHEMBL8031376

C=CC(=O)OCc1ccc(O)c2ncccc12

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 12/20 0.60
NPC1 O15118 5/20 0.60
HTT P42858 4/20 0.60
RAB9A P51151 4/20 0.60
ALOX12 P18054 1/20 0.60
NPSR1 Q6W5P4 1/20 0.60
L3MBTL1 Q9Y468 8/20 0.56
LMNA P02545 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
GAA P10253 1/20 0.56
BRD4 O60885 2/20 0.55
MITF O75030 1/20 0.55
MAPT P10636 3/20 0.54
ALDH1A1 P00352 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
TP53 P04637 1/20 0.54
POLB P06746 1/20 0.54
TSHR P16473 1/20 0.54
MAPK1 P28482 1/20 0.54
PAX8 Q06710 1/20 0.50

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
SCHEMBL9154243 0.85 KDM4E (0.61) KDM4ENPC1HTTRAB9AALOX12
SCHEMBL27836693 0.82 KDM4E (0.65) KDM4ENPC1HTTRAB9AALOX12
SCHEMBL8030827 0.81 KDM4E (0.63) KDM4ENPC1HTTRAB9AALOX12
SCHEMBL24609573 0.80 THRB (0.43) ALDH1A1TP53TSHRHIF1A
SCHEMBL11673721 0.78 KDM4E (0.65) KDM4ENPC1HTTRAB9AALOX12
SCHEMBL27696507 0.77 MMP2 (0.44) KDM4EHTTNPSR1L3MBTL1LMNA
SCHEMBL28625499 0.77 KDM4E (0.54) KDM4ENPC1HTTRAB9AALOX12
SCHEMBL31625458 0.76 KDM4E (0.56) KDM4ENPC1HTTRAB9AALOX12
SCHEMBL4468901 0.76 KDM4E (1.00) KDM4ENPC1HTTRAB9AALOX12
SCHEMBL13415788 0.76 KDM4E (0.72) KDM4ENPC1HTTRAB9AALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0683436-B1 Liquid toners utilizing highly fluorinated solvents MINNESOTA MINING & MFG (US) 2000-03-22 EP disclosed
EP-0594472-B1 Liquid toners for use with perfluorinated solvents MINNESOTA MINING & MFG (US) 1999-05-19 EP disclosed
US-5530053-A ELECTROSTATIC TONERS COMPRISING POLYMERIC DYES CONTAINING FLUORINATED MACROMERS COMPLEXED WITH A METAL CHARGE CONTROLLER; ANTIAGGLOMERANTS; QUICK-DRYING; TRANSFERABILITY; NON-FLAMMABLE; ELECTROGRAPHY MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-06-25 US disclosed
US-5530067-A GRAFT FLUOROPOLYMERIC DYES FOR USE ELECTROGRAPHIC PROCESS; HIGH SPEED DRYING MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-06-25 US disclosed
EP-0683436-A1 Liquid toners utilizing highly fluorinated solvents MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-11-22 EP disclosed
US-5397669-A Liquid toners for use with perfluorinated solvents MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-03-14 US disclosed
EP-0594472-A2 Liquid toners for use with perfluorinated solvents MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-04-27 EP disclosed
US-5283148-A Liquid toners for use with perfluorinated solvents MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-02-01 US disclosed
US-4077820-A Gelled-water bearing explosive composition ICI AUSTRALIA LIMITED (AU) 1978-03-07 US disclosed