SCHEMBL11682345

SCHEMBL11682345

CN(c1cccc(CS(=O)(=O)O)c1)S(=O)(=O)c1cc(Cl)c(N)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ MCOLN3 Q8TDD5 1/20 0.41
▸ LMNA P02545 4/20 0.40
▸ MAPT P10636 3/20 0.39
▸ TP53 P04637 1/20 0.39
▸ GSTO1 P78417 1/20 0.37
▸ MEN1 O00255 3/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ GLA P06280 1/20 0.35
▸ HSD17B1 P14061 2/20 0.34
▸ HSD17B2 P37059 2/20 0.34
▸ USP2 O75604 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL11680630 0.88 ALDH1A1 (0.43) KDM4EALDH1A1MCOLN3LMNAMAPT
SCHEMBL11683080 0.86 LMNA (0.41) KDM4EALDH1A1LMNAMAPTMEN1
SCHEMBL11682666 0.83 KDM4E (0.45) KDM4EALDH1A1MCOLN3LMNAMAPT
Methane SCHEMBL11682364 0.82 KDM4E (0.44) KDM4EALDH1A1MCOLN3LMNAMAPT
SCHEMBL11685235 0.81 KDM4E (0.42) KDM4EALDH1A1MCOLN3LMNAMAPT
SCHEMBL11657083 0.76 ALDH1A1 (0.47) KDM4EALDH1A1MCOLN3LMNAMAPT
Methane SCHEMBL11681369 0.75 ALDH1A1 (0.46) KDM4EALDH1A1MCOLN3LMNAMAPT
SCHEMBL11683441 0.73 MEN1 (0.51) ALDH1A1LMNAMEN1KMT2AHSD17B1
SCHEMBL11681883 0.73 ALDH1A1 (0.41) KDM4EALDH1A1LMNAMAPTMEN1
SCHEMBL11680118 0.73 SREBF1 (0.42) ALDH1A1LMNAMAPTMEN1KMT2A

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
Send feedback