SCHEMBL3469763

SCHEMBL3469763

FC(F)(F)Oc1cccc(-c2cnc3c(N4CCOCC4)nccn23)c1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 7/20 0.57
▸ PDE5A O76074 1/20 0.56
▸ PDE6A P16499 1/20 0.56
▸ PDE1B Q01064 1/20 0.56
▸ PDE3A Q14432 1/20 0.56
▸ PRKDC P78527 1/20 0.47
▸ PIM1 P11309 5/20 0.47
▸ SLC6A3 Q01959 1/20 0.44
▸ FYN P06241 1/20 0.44
▸ GRIA1 P42261 1/20 0.44
▸ PIM3 Q86V86 1/20 0.44
▸ PIM2 Q9P1W9 1/20 0.44

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
SCHEMBL3467008 0.88 FLT3 (0.48) DYRK1APDE5APDE6APDE1BPDE3A
SCHEMBL3467938 0.87 PDE5A (0.67) PDE5APDE6APDE1BPDE3APRKDC
SCHEMBL3466485 0.83 GRIA1 (0.60) PDE5APDE6APDE1BPDE3ASLC6A3
SCHEMBL3467072 0.81 PDE5A (0.59) PDE5APDE6APDE1BPDE3ASLC6A3
SCHEMBL3469571 0.78 PDE5A (0.63) PDE5APDE6APDE1BPDE3ASLC6A3
SCHEMBL3467028 0.76 PDE5A (0.60) PDE5APDE6APDE1BPDE3ASLC6A3
SCHEMBL5400838 0.76 DYRK1A (0.50) DYRK1APIM1FYN
SCHEMBL3467020 0.74 PDE5A (0.60) PDE5APDE6APDE1BPDE3ASLC6A3
SCHEMBL13734710 0.72 DYRK1A (0.55) DYRK1APRKDCPIM1
SCHEMBL16332001 0.72 KCNH2 (0.48) DYRK1APRKDCPIM1FYN

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
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