SCHEMBL7625992

SCHEMBL7625992

Oc1ccc(Cn2cccn2)cc1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.55
MAPT P10636 2/20 0.55
HDAC1 Q13547 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
HTT P42858 1/20 0.51
CA2 P00918 2/20 0.50
NOS3 P29474 1/20 0.50
NOS1 P29475 1/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA9 Q16790 1/20 0.50
TSHR P16473 2/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
BRD4 O60885 2/20 0.47
DBH P09172 1/20 0.47
CYP19A1 P11511 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 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
SCHEMBL18235820 0.85 GAA (0.59) GAAMAPTHDAC1HDAC6HTT
SCHEMBL25331542 0.82 GAA (0.52) GAAMAPTHDAC1HDAC6HTT
SCHEMBL7627846 0.81 MAPT (0.62) GAAMAPTHDAC1HDAC6HTT
SCHEMBL8382530 0.81 MAPT (0.55) GAAMAPTHDAC1HDAC6HTT
SCHEMBL7635734 0.81 HTT (0.51) GAAMAPTHDAC1HDAC6HTT
SCHEMBL17310038 0.78 GAA (0.55) GAAMAPTHDAC1HDAC6HTT
SCHEMBL3397894 0.78 GAA (0.67) GAAMAPTHDAC1HDAC6HTT
SCHEMBL25956018 0.78 GAA (0.51) GAAMAPTHDAC1HDAC6HTT
SCHEMBL25335099 0.78 MAPT (0.51) GAAMAPTHDAC1HDAC6HTT
SCHEMBL7633468 0.77 CYP19A1 (0.50) GAACA2CA1TSHRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0754683-B1 ETHER COMPOUND, USE THEREOF, AND INTERMEDIATE FOR PRODUCING THE COMPOUND SUMITOMO CHEMICAL CO (JP) 2002-08-14 EP disclosed
CN-1079794-C Ether compound, use thereof, and intermediate for producing the compound SUMITOMO CHEM IND (JP) 2002-02-27 CN disclosed
US-5972949-A COMPOUNDS SUCH AS 4-(1-PYRAZOLYL)METHYLPHENYL 2-(2-PYRIMIDYLOXY) ETHYL ETHER; INSECTICIDAL AND/OR ACARICIDAL AGENTS SUMITO CHEMICAL CO., LTD. (JP) 1999-10-26 US disclosed
CN-1043041-C Heterocyclic group-containing ether derivative and insecticide containing the same as active ingredient SUMITOMO CHEMICAL CO (JP) 1999-04-21 CN disclosed
US-5883262-A INSECTICIDES, ACARICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-03-16 US disclosed
US-5684022-A ANTIFERTILITY AGENT PESTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-11-04 US disclosed
CN-1151160-A Ether compound and use thereof SUMITOMO CHEMICAL CO (JP) 1997-06-04 CN disclosed
CN-1149289-A Ether compounds, their use and intermediates for their preparation SUMITOMO CHEMICAL CO (JP) 1997-05-07 CN disclosed
EP-0757048-A1 ETHER COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1997-02-05 EP disclosed
EP-0754683-A1 ETHER COMPOUND, USE THEREOF, AND INTERMEDIATE FOR PRODUCING THE COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1997-01-22 EP disclosed