SCHEMBL11683078

SCHEMBL11683078

CCN(c1ccc(Oc2ccccc2)c(S(=O)(=O)O)c1)S(=O)(=O)c1cc(Cl)c(N)c(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ POLB P06746 3/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ RXFP1 Q9HBX9 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ APEX1 P27695 1/20 0.42
▸ KEAP1 Q14145 2/20 0.42
▸ NFE2L2 Q16236 2/20 0.42
▸ PGR P06401 4/20 0.40
▸ NR1I2 O75469 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ DUSP3 P51452 1/20 0.40
▸ PTPN5 P54829 1/20 0.40
▸ PTPN11 Q06124 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ CTDSP1 Q9GZU7 1/20 0.40

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
SCHEMBL11686057 0.77 PGR (0.51) SMN1; SMN2POLBL3MBTL1RXFP1MEN1
SCHEMBL11685526 0.74 PGR (0.51) POLBL3MBTL1RXFP1MEN1KMT2A
SCHEMBL11684709 0.73 PGR (0.49) SMN1; SMN2POLBL3MBTL1RXFP1MEN1
SCHEMBL8769337 0.69 POLB (0.56) SMN1; SMN2POLBL3MBTL1RXFP1MEN1
SCHEMBL11685529 0.68 POLB (0.43) SMN1; SMN2POLBL3MBTL1RXFP1MEN1
SCHEMBL6152252 0.67 SMN1; SMN2 (0.53) SMN1; SMN2POLBL3MBTL1RXFP1MEN1
SCHEMBL5464725 0.66 ALDH1A1 (0.58) SMN1; SMN2MEN1KMT2AKDM4EALDH1A1
SCHEMBL11742164 0.66 CYP1A2 (0.50) SMN1; SMN2POLBL3MBTL1RXFP1MEN1
SCHEMBL11686420 0.66 ESR1 (0.46) SMN1; SMN2KDM4EALDH1A1MAPTALOX15
SCHEMBL7551579 0.65 HSD17B10 (0.43) SMN1; SMN2POLBL3MBTL1RXFP1MEN1

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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