SCHEMBL11097054

SCHEMBL11097054

Nc1ccc(NS(=O)(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.67
ALDH1A1 P00352 6/20 0.51
SLC25A1 P53007 1/20 0.50
LMNA P02545 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
POLB P06746 1/20 0.46
PKM P14618 1/20 0.46
BCL2L1 Q07817 1/20 0.46
MCL1 Q07820 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
CYP2C9 P11712 1/20 0.46
ATIC P31939 1/20 0.46
CYP2C19 P33261 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL11092857 0.95 FFAR4 (0.70) FFAR4ALDH1A1SLC25A1LMNAL3MBTL1
SCHEMBL11092515 0.87 ALDH1A1 (0.56) FFAR4ALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL11094292 0.87 FFAR4 (0.81) FFAR4ALDH1A1LMNAMEN1KMT2A
SCHEMBL11089286 0.81 KMT2A (0.56) FFAR4ALDH1A1MEN1KMT2APOLB
SCHEMBL11100512 0.81 FFAR4 (0.68) FFAR4ALDH1A1LMNAMEN1KMT2A
SCHEMBL11100495 0.81 FFAR4 (0.64) FFAR4ALDH1A1LMNAL3MBTL1MEN1
SCHEMBL11083018 0.81 FFAR4 (0.67) FFAR4ALDH1A1LMNAMEN1KMT2A
SCHEMBL10618991 0.80 FFAR4 (1.00) FFAR4ALDH1A1LMNAMEN1KMT2A
SCHEMBL1251538 0.80 FFAR4 (0.66) FFAR4ALDH1A1LMNAMEN1KMT2A
SCHEMBL11088635 0.79 KMT2A (0.56) ALDH1A1MEN1KMT2APOLBPKM

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