SCHEMBL7254179

SCHEMBL7254179

O=C(Cn1c(=O)cc(Nc2ccc3c(c2)CCC3)[nH]c1=O)N1CCN(c2ccccc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ ALDH1A1 P00352 3/20 0.43
▸ MAPT P10636 3/20 0.43
▸ KMT2A Q03164 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ PARP1 P09874 1/20 0.42
▸ PSMD14 O00487 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ ELANE P08246 2/20 0.41

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
SCHEMBL8154174 0.82 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1MAPTKMT2AMEN1
SCHEMBL8154422 0.75 — —
SCHEMBL7263989 0.74 KDM4E (0.44) SMN1; SMN2ALDH1A1MAPTKMT2AMEN1
SCHEMBL7257430 0.74 NPC1 (0.43) ALDH1A1MAPTKMT2AMEN1
SCHEMBL7258099 0.74 — —
SCHEMBL7253779 0.73 — —
SCHEMBL5940600 0.73 — —
SCHEMBL8152565 0.72 — —
SCHEMBL7263484 0.71 KDM4E (0.41) SMN1; SMN2ALDH1A1KDM4E
SCHEMBL7259083 0.71 — —

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003000665-A1 ANTIBACTERIAL URACIL DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2003-01-03 — — WO disclosed
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