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SCHEMBL6885709

SCHEMBL6885709

O=S(=O)(O)C1(S(=O)(=O)O)CC(N=C=S)=CC=C1C=Cc1ccc(N=C=S)cc1.O=S(=O)(O)c1cc(N=C=S)ccc1C=CC1C=CC(N=C=S)=CC1S(=O)(=O)O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RAD1 O60671 1/20 0.42
▸ P2RY6 Q15077 1/20 0.42
▸ KDM4E B2RXH2 2/20 0.33
▸ USP2 O75604 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ LTA P01374 2/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ P2RX3 P56373 2/20 0.33
▸ RAD51 Q06609 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ TDP1 Q9NUW8 2/20 0.33

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
SCHEMBL38215 0.83 RAD1 (0.60) RAD1P2RY6KDM4EUSP2ALDH1A1
SCHEMBL38214 0.83 RAD1 (0.60) RAD1P2RY6KDM4EUSP2ALDH1A1
SCHEMBL724194 0.82 RAD1 (0.62) RAD1P2RY6KDM4EUSP2ALDH1A1
SCHEMBL9208067 0.82 RAD1 (0.59) RAD1P2RY6KDM4EUSP2ALDH1A1
SCHEMBL724195 0.82 RAD1 (0.62) RAD1P2RY6KDM4EUSP2ALDH1A1
SCHEMBL6885716 0.81 RAD1 (0.46) RAD1P2RY6KDM4EUSP2ALDH1A1
SCHEMBL3862401 0.77 RAD1 (0.38) RAD1P2RY6KDM4EUSP2ALDH1A1
SCHEMBL5615707 0.76 RAD1 (0.37) RAD1P2RY6KDM4EUSP2ALDH1A1
SCHEMBL1563448 0.75 RAD1 (0.60) RAD1P2RY6KDM4EUSP2ALDH1A1
SCHEMBL30425679 0.74 RAD1 (0.47) RAD1P2RY6KDM4EUSP2ALDH1A1

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-2004106890-A2 TRACE INCORPORATION OF FLUORESCENT MONOMER FACILITATING QUALITY CONTROL OF POLYMERIZATION REACTIONS CIPHERGEN BIOSYSTEMS, INC. (US) 2004-12-09 — — WO disclosed