SCHEMBL8045149

SCHEMBL8045149

CCN(CC)c1ccc(N=Nc2c(Cl)cc(S(=O)(=O)F)c(Cl)c2Br)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 11/20 0.39
MAPT P10636 11/20 0.39
MEN1 O00255 10/20 0.39
ALDH1A1 P00352 9/20 0.39
KDM4E B2RXH2 8/20 0.39
TDP1 Q9NUW8 8/20 0.39
L3MBTL1 Q9Y468 7/20 0.39
LMNA P02545 4/20 0.39
CYP2C9 P11712 3/20 0.39
CYP2C19 P33261 3/20 0.39
ATM Q13315 3/20 0.39
HTT P42858 3/20 0.39
CYP1A2 P05177 2/20 0.39
GLA P06280 2/20 0.39
CYP3A4 P08684 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
USP2 O75604 1/20 0.39
S1PR2 O95136 1/20 0.39
TP53 P04637 1/20 0.39
ALOX15 P16050 1/20 0.39

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
SCHEMBL8045147 1.00 KMT2A (0.39) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL8050513 0.89 KMT2A (0.34) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL8046210 0.86 MAPT (0.32) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL8046207 0.86 MAPT (0.32) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL8053537 0.86 CA12 (0.34) KMT2AMAPTALDH1A1KDM4EL3MBTL1
SCHEMBL8053532 0.86 CA12 (0.34) KMT2AMAPTALDH1A1KDM4EL3MBTL1
SCHEMBL8091987 0.86 L3MBTL1 (0.33) KMT2AMEN1ALDH1A1KDM4ETDP1
SCHEMBL8035876 0.86 L3MBTL1 (0.33) KMT2AMEN1ALDH1A1KDM4ETDP1
SCHEMBL14944896 0.82 MAPT (0.39) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL23695516 0.74 MAPT (0.47) KMT2AMAPTMEN1ALDH1A1KDM4E

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6048370-A Monoazo dyes containing a fluorosulphonyl group and use thereof BASF AKTIENGESELLSCHAFT (DE) 2000-04-11 US claimed
EP-0888405-B1 MONOAZO DYES CONTAINING A FLUOROSULPHONYL GROUP AND USE THEROF BASF AG (DE) 2000-04-26 EP disclosed
US-6048370-A Monoazo dyes containing a fluorosulphonyl group and use thereof BASF AKTIENGESELLSCHAFT (DE) 2000-04-11 US disclosed
EP-0888405-A1 MONOAZO DYES CONTAINING A FLUOROSULPHONYL GROUP AND USE THEROF BASF AKTIENGESELLSCHAFT (DE) 1999-01-07 EP disclosed
WO-1997029155-A1 MONOAZO DYES CONTAINING A FLUOROSULPHONYL GROUP AND USE THEROF BASF AKTIENGESELLSCHAFT (DE) 1997-08-14 WO disclosed