SCHEMBL3465843

SCHEMBL3465843

OCc1cccc(-c2cnc3c(Nc4cccc(C(F)(F)F)c4)nccn23)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.43
▸ ADORA3 P0DMS8 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ GMNN O75496 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ TTR P02766 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ NFKB1 P19838 1/20 0.43
▸ UGT1A1 P22309 1/20 0.43
▸ PTGS1 P23219 1/20 0.43
▸ PTGS2 P35354 1/20 0.43
▸ PMP22 Q01453 1/20 0.43
▸ DHODH Q02127 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ TEAD4 Q15561 1/20 0.43
▸ HIF1A Q16665 1/20 0.43
▸ GPR35 Q9HC97 1/20 0.43

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
SCHEMBL3466303 0.87 GAA (0.53) LMNAMEN1GMNNALDH1A1TTR
SCHEMBL3465711 0.83 SYK (0.45) LMNAMEN1GMNNALDH1A1TTR
SCHEMBL3469213 0.83 FYN (0.55) LMNAMEN1GMNNALDH1A1TTR
SCHEMBL3465798 0.83 BRAF (0.51) LMNAMEN1GMNNALDH1A1TTR
SCHEMBL3467043 0.83 ABCG2 (0.54) LMNACYP1A2CYP3A4TDP1BRAF
SCHEMBL3466944 0.83 DYRK1A (0.44) LMNAADORA3MEN1GMNNALDH1A1
SCHEMBL3466032 0.82 RAD52 (0.49) TTKBRAFDDR1DDR2KIT
SCHEMBL3467002 0.81 LMNA (0.54) LMNAMEN1GMNNALDH1A1TTR
SCHEMBL3466290 0.81 KIT (0.46) LMNAMEN1GMNNALDH1A1TTR
SCHEMBL3466900 0.80 CTSC (0.52) LMNAMEN1GMNNALDH1A1TTR

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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