SCHEMBL5507591

SCHEMBL5507591

Oc1cc(F)c(F)c2c(NC(F)(F)F)cccc12

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
APP P05067 1/20 0.32
MAPT P10636 1/20 0.32
THRB P10828 1/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
CASP1 P29466 1/20 0.32
SNCA P37840 1/20 0.32
RECQL P46063 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PLA2G7 Q13093 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
TRPV1 Q8NER1 1/20 0.30

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
SCHEMBL5511582 0.81 IDO1 (0.41) KDM4EL3MBTL1APPMAPTTHRB
SCHEMBL5507012 0.81 MAPT (0.42) KDM4EL3MBTL1APPMAPTTHRB
SCHEMBL5509695 0.78 MAPT (0.31) KDM4EAPPMAPTTHRBHPGD
SCHEMBL5511502 0.76 MEN1 (0.30) KDM4E
SCHEMBL5516167 0.76 KDM4E (0.32) KDM4EL3MBTL1PLA2G7
SCHEMBL5518010 0.76 HPGD (0.52) APPMAPTTHRBHPGDALOX15
SCHEMBL5514243 0.74 IDO1 (0.38) KDM4ECA9TRPV1
SCHEMBL5514103 0.72 ADRB1 (0.36) KDM4EL3MBTL1MAPTHPGDALOX15
SCHEMBL5522970 0.71 TSHR (0.38) KDM4EAPPMAPTTHRBHPGD
SCHEMBL5514072 0.69 IDO1 (0.35) KDM4EL3MBTL1TRPV1

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-7208559-B2 Ethylened polymer and molded object obtained therefrom MITSUI CHEMICALS, INC. (JP) 2007-04-24 US disclosed
US-20060135712-A1 Ethylened polymer and molded object obtained therefrom MITSUI CHEMICALS, INC. (JP) 2006-06-22 US disclosed