SCHEMBL11685529

SCHEMBL11685529

Nc1c(Cl)cccc1Cl.O=S(=O)=Nc1ccc(Oc2ccccc2)c(S(=O)(=O)O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 4/20 0.43
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ RXFP1 Q9HBX9 2/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ APEX1 P27695 1/20 0.43
▸ SLC7A11 Q9UPY5 2/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ P2RX4 Q99571 8/20 0.39
▸ MAPT P10636 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ DUSP3 P51452 1/20 0.37
▸ PTPN5 P54829 1/20 0.37
▸ PTPN11 Q06124 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ CTDSP1 Q9GZU7 1/20 0.37
▸ CYP2C9 P11712 2/20 0.36
▸ ACLY P53396 2/20 0.36

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
Aniline SCHEMBL11683015 0.87 POLB (0.47) POLBL3MBTL1RXFP1MEN1KMT2A
SCHEMBL11680641 0.86 CYP2C9 (0.48) POLBL3MBTL1RXFP1MEN1KMT2A
SCHEMBL11682813 0.80 POLB (0.41) POLBL3MBTL1RXFP1MEN1KMT2A
3-Chloroaniline SCHEMBL11686685 0.74 SMN1; SMN2 (0.39) POLBL3MBTL1SMN1; SMN2MAPTKDM4E
SCHEMBL8769337 0.72 POLB (0.56) POLBL3MBTL1RXFP1MEN1KMT2A
SCHEMBL11685526 0.71 PGR (0.51) POLBL3MBTL1RXFP1MEN1KMT2A
SCHEMBL11684034 0.71 ALDH1A1 (0.39) POLBL3MBTL1MEN1KMT2ASMN1; SMN2
SCHEMBL6152252 0.71 SMN1; SMN2 (0.53) POLBL3MBTL1RXFP1MEN1KMT2A
SCHEMBL11742164 0.69 CYP1A2 (0.50) POLBL3MBTL1RXFP1MEN1KMT2A
SCHEMBL11682462 0.69 TSHR (0.42) MEN1KMT2ASMN1; SMN2MAPTHSD17B10

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-4055557-A MONOAZO DYES BAYER AKTIENGESELLSCHAFT (DT) 1977-10-25 — — US disclosed
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