SCHEMBL14591267

SCHEMBL14591267

O=C(CCN(c1ccccc1)C1C[C@H]1Nc1ccccc1)Nc1cccc(-n2c(S)nnc2S)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ GAA P10253 2/20 0.37
▸ ALDH1A1 P00352 6/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ HDAC3 O15379 4/20 0.36
▸ HDAC1 Q13547 3/20 0.36
▸ HDAC2 Q92769 3/20 0.36
▸ HDAC10 Q969S8 3/20 0.36
▸ HDAC8 Q9BY41 3/20 0.36
▸ HDAC6 Q9UBN7 3/20 0.36
▸ POLB P06746 5/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ USP2 O75604 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ BLM P54132 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ EGFR P00533 1/20 0.35

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
SCHEMBL13271612 1.00 MAPT (0.37) MAPTSMN1; SMN2GAAALDH1A1ALOX15
SCHEMBL14394645 1.00 MAPT (0.37) MAPTSMN1; SMN2GAAALDH1A1ALOX15
SCHEMBL14484329 0.80 ALDH1A1 (0.40) MAPTGAAALDH1A1ALOX15HDAC3
SCHEMBL14484221 0.78 HDAC3 (0.40) MAPTGAAALDH1A1ALOX15HDAC3
SCHEMBL14359778 0.74 TERT (0.46) MAPTSMN1; SMN2GAAALDH1A1HDAC3
SCHEMBL14497470 0.73 POLB (0.50) SMN1; SMN2ALDH1A1POLBMEN1KMT2A
SCHEMBL14093908 0.73 POLB (0.42) MAPTSMN1; SMN2ALDH1A1HDAC3HDAC1
SCHEMBL14093873 0.71 TERT (0.40) MAPTGAAALDH1A1HDAC3HDAC1
SCHEMBL17153815 0.70 POLB (0.44) MAPTALDH1A1POLBMEN1KMT2A
SCHEMBL13656906 0.67 POLB (0.42) GAAHDAC6POLBMEN1KMT2A

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
US-7186501-B2 Photothermographic material containing particular hydrophilic polymer FUJIFILM CORPORATION (JP) 2007-03-06 — — US disclosed
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