SCHEMBL24426964

SCHEMBL24426964

NC(=O)N1CCCC(C(O)Nc2sc3c(c2C(=O)Nc2ccc(Cl)cc2)CCC3)C1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 3/20 0.51
▸ ANO1 Q5XXA6 5/20 0.50
▸ MAPT P10636 3/20 0.48
▸ FLT3 P36888 1/20 0.47
▸ RXFP1 Q9HBX9 1/20 0.44
▸ THRB P10828 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ TNF P01375 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ NOD1 Q9Y239 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 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
SCHEMBL20339095 0.85 ANO1 (0.55) TP53ANO1MAPTFLT3RXFP1
SCHEMBL20354020 0.81 TP53 (0.56) TP53ANO1MAPTFLT3RXFP1
SCHEMBL20353904 0.80 TP53 (0.53) TP53ANO1MAPTFLT3RXFP1
SCHEMBL20354011 0.75 TP53 (0.56) TP53ANO1MAPTFLT3RXFP1
SCHEMBL20353881 0.74 SMN1; SMN2 (0.53) TP53ANO1MAPTRXFP1THRB
SCHEMBL24426825 0.74 ANO1 (0.52) TP53ANO1MAPTFLT3RXFP1
SCHEMBL20340274 0.73 ANO1 (0.49) TP53ANO1MAPTFLT3RXFP1
SCHEMBL20339093 0.73 ANO1 (0.58) TP53ANO1MAPTFLT3RXFP1
SCHEMBL20353932 0.73 ANO1 (0.60) TP53ANO1MAPTRXFP1THRB
SCHEMBL8289815 0.73 ANO1 (0.68) TP53ANO1MAPTFLT3RXFP1

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
EP-3562818-B1 THIOPHENE DERIVATIVES AS ANTIVIRAL AGENTS ENYO PHARMA (FR) 2022-05-18 — — EP disclosed
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