SCHEMBL5507012

SCHEMBL5507012

Oc1ccc(F)c2c(NC(F)(F)F)cccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.42
HSD17B10 Q99714 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
APP P05067 1/20 0.42
THRB P10828 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
CASP1 P29466 1/20 0.42
SNCA P37840 1/20 0.42
RECQL P46063 1/20 0.42
KDM4E B2RXH2 8/20 0.38
IDO1 P14902 5/20 0.38
L3MBTL1 Q9Y468 4/20 0.38
MPI P34949 1/20 0.38
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
TRPV1 Q8NER1 2/20 0.33
KMT2A Q03164 2/20 0.33
MITF O75030 1/20 0.33

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
SCHEMBL5507591 0.81 KDM4E (0.33) MAPTHSD17B10TDP1APPTHRB
SCHEMBL5507586 0.79 IDO1 (0.52) MAPTHSD17B10TDP1APPTHRB
SCHEMBL5513683 0.79 TMPRSS4 (0.31) KDM4EIDO1L3MBTL1MPI
SCHEMBL5511502 0.79 MEN1 (0.30) KDM4ENPC1RAB9AKMT2AHSD17B2
SCHEMBL5514072 0.75 IDO1 (0.35) KDM4EIDO1L3MBTL1MPINPC1
SCHEMBL5522395 0.74 HPGD (0.70) MAPTHSD17B10TDP1APPTHRB
SCHEMBL5509695 0.73 MAPT (0.31) MAPTHSD17B10TDP1APPTHRB
SCHEMBL5514103 0.71 ADRB1 (0.36) MAPTHSD17B10TDP1HPGDALOX15
SCHEMBL5514243 0.70 IDO1 (0.38) KDM4EIDO1TRPV1LMNAHTT
SCHEMBL5515524 0.69 TSHR (0.50) MAPTHSD17B10TDP1APPTHRB

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