SCHEMBL3467720

SCHEMBL3467720

CC(=O)Nc1cccc(-c2cnc3c(NCc4ccco4)nccn23)c1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FYN P06241 11/20 0.62
MAPT P10636 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
KDM4E B2RXH2 1/20 0.52
MEN1 O00255 1/20 0.52
ALDH1A1 P00352 1/20 0.52
KMT2A Q03164 1/20 0.52
HSD17B10 Q99714 1/20 0.52
EED O75530 2/20 0.46
TTK P33981 3/20 0.44
TP53 P04637 1/20 0.44
GAA P10253 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ZAP70 P43403 1/20 0.43
KARS1 Q15046 1/20 0.43
BRAF P15056 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
SCHEMBL3466367 0.89 FYN (0.61) FYNMAPTMEN1ALDH1A1KMT2A
SCHEMBL3476687 0.84 EED (0.51) FYNEEDTTKZAP70KARS1
SCHEMBL3466505 0.83 FYN (0.58) FYNTTKBRAF
SCHEMBL3470453 0.82 TTK (0.64) FYNTTKBRAF
SCHEMBL5416134 0.82 FYN (0.54) FYNTTKBRAF
SCHEMBL3469327 0.81 EED (0.48) FYNMAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL3469619 0.81 TTK (0.59) FYNTTK
SCHEMBL3469970 0.80 BRAF (0.57) FYNMAPTSMN1; SMN2KDM4EMEN1
SCHEMBL12409290 0.80 TTK (0.46) FYNTTKZAP70BRAF
SCHEMBL3466056 0.80 TTK (0.57) FYNSMN1; SMN2TTKTP53BRAF

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
WO-2010069684-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-06-24 WO claimed
WO-2010069684-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-06-24 WO disclosed