SCHEMBL11089286

SCHEMBL11089286

Nc1ccc(S(=O)(=O)Nc2ccc(N)c(C(=O)O)c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.56
MEN1 O00255 3/20 0.56
KEAP1 Q14145 1/20 0.55
HTR6 P50406 3/20 0.55
CA1 P00915 2/20 0.54
CA2 P00918 2/20 0.54
HTT P42858 1/20 0.54
CA9 Q16790 1/20 0.54
ALDH1A1 P00352 2/20 0.53
PTPN5 P54829 1/20 0.53
USP2 O75604 1/20 0.51
POLB P06746 1/20 0.51
MAPT P10636 1/20 0.51
THRB P10828 1/20 0.51
PKM P14618 1/20 0.51
APEX1 P27695 1/20 0.51
RECQL P46063 1/20 0.51
BLM P54132 1/20 0.51
MCL1 Q07820 1/20 0.51
TDP1 Q9NUW8 1/20 0.51

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
SCHEMBL11088635 0.91 KMT2A (0.56) KMT2AMEN1KEAP1HTR6CA1
SCHEMBL11092515 0.91 ALDH1A1 (0.56) KMT2AMEN1ALDH1A1PTPN5POLB
SCHEMBL150434 0.84 MCL1 (0.68) KMT2AMEN1KEAP1HTR6CA1
SCHEMBL11096707 0.82 KMT2A (0.56) KMT2AMEN1HTTALDH1A1POLB
SCHEMBL11097054 0.81 FFAR4 (0.67) KMT2AMEN1ALDH1A1POLBMAPT
SCHEMBL11095772 0.81 ALDH1A1 (0.49) KMT2AMEN1HTTALDH1A1PTPN5
SCHEMBL9335131 0.81 KMT2A (0.57) KMT2AMEN1KEAP1HTTCA9
SCHEMBL2565577 0.80 MCL1 (0.62) KMT2AMEN1KEAP1HTR6CA1
SCHEMBL11798754 0.80 KMT2A (0.52) KMT2AMEN1KEAP1CA1CA2
SCHEMBL11092857 0.79 FFAR4 (0.70) KMT2AMEN1ALDH1A1POLBPKM

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-4479906-A BLACK LEATHER DYE BASF AKTIENGESELLSCHAFT (DE) 1984-10-30 US disclosed