SCHEMBL3246352

SCHEMBL3246352

FC(F)(F)Oc1cccc(Nc2ccc(-c3ccc(C(F)(F)F)cc3)cn2)c1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSC P53634 9/20 0.53
SYK P43405 1/20 0.48
IGF1R P08069 2/20 0.47
KDM4E B2RXH2 2/20 0.46
GAA P10253 1/20 0.46
GALR2 O43603 1/20 0.44
GALR1 P47211 1/20 0.44
MAPT P10636 2/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
KIF11 P52732 1/20 0.43
EPHX2 P34913 1/20 0.43
TNNI3K Q59H18 1/20 0.42

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
SCHEMBL3243096 0.84 CTSC (0.61) CTSCKDM4EGAAMAPTMEN1
SCHEMBL3234950 0.84 CTSC (0.52) CTSCSYKIGF1RGALR2GALR1
SCHEMBL3242880 0.82 BRAF (0.54) CTSCSYKMAPTKMT2A
SCHEMBL3247964 0.81 CTSC (0.49) CTSCSYKIGF1RGALR2GALR1
SCHEMBL3244704 0.80 SYK (0.52) CTSCSYKIGF1RGAAGALR2
SCHEMBL3247690 0.79 IGF1R (0.53) CTSCSYKIGF1RGALR2GALR1
SCHEMBL3245571 0.79 ABL1 (0.59) CTSCSYKKDM4EMAPT
SCHEMBL3247802 0.79 BRAF (0.58) CTSCSYKKDM4EMAPTMEN1
SCHEMBL3245277 0.79 ABL1 (0.55) CTSCMAPTMEN1KMT2AKIF11
SCHEMBL3239225 0.79 KIF11 (0.53) CTSCSYKIGF1RGALR2GALR1

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
WO-2010057833-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-05-27 WO claimed
WO-2010057833-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-05-27 WO disclosed
WO-2010057833-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-05-27 WO disclosed