SCHEMBL3466296

SCHEMBL3466296

COc1ccc(-c2cnc3c(Nc4cccc(C(F)(F)F)c4)nccn23)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.48
RXFP1 Q9HBX9 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
KDR P35968 1/20 0.48
APP P05067 1/20 0.46
ABCG2 Q9UNQ0 5/20 0.46
EGFR P00533 1/20 0.45
SRC P12931 1/20 0.45
FYN P06241 1/20 0.45
TTK P33981 1/20 0.45
GSK3B P49841 1/20 0.44
BRAF P15056 1/20 0.44
ABL1 P00519 1/20 0.43
KIT P10721 1/20 0.43
BCR P11274 1/20 0.43
DDR1 Q08345 1/20 0.43
DDR2 Q16832 1/20 0.43
SYK P43405 1/20 0.42
LMNA P02545 2/20 0.42
MAPT P10636 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
SCHEMBL3467043 0.91 ABCG2 (0.54) POLBRXFP1TDP1KDRABCG2
SCHEMBL3466346 0.90 TTK (0.45) POLBTDP1ABCG2EGFRFYN
SCHEMBL3466230 0.89 MAPT (0.47) POLBTDP1KDRABCG2EGFR
SCHEMBL3466253 0.89 MC4R (0.54) ABCG2EGFRSRCFYNTTK
SCHEMBL3470499 0.83 FYN (0.62) POLBRXFP1TDP1KDRABCG2
SCHEMBL3466944 0.83 DYRK1A (0.44) POLBTDP1KDRABCG2FYN
SCHEMBL3466303 0.82 GAA (0.53) POLBTDP1KDRABCG2FYN
SCHEMBL3466900 0.81 CTSC (0.52) TDP1TTKLMNA
SCHEMBL3465711 0.80 SYK (0.45) POLBTDP1KDRABCG2FYN
SCHEMBL3466340 0.80 CLK4 (0.55) POLBRXFP1TDP1KDRFYN

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