SCHEMBL27587720

SCHEMBL27587720

NC(=O)N(c1ccc(Br)cc1)c1ccc([N+](=O)[O-])cc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 2/20 0.43
GAA P10253 1/20 0.42
THRB P10828 1/20 0.42
KMT2A Q03164 6/20 0.41
MEN1 O00255 5/20 0.41
POLB P06746 3/20 0.41
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 5/20 0.40
CXCR1 P25024 1/20 0.40
CXCR2 P25025 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TP53 P04637 2/20 0.40
TSHR P16473 2/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.38
HTT P42858 2/20 0.38

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
SCHEMBL27605699 0.93 GPR35 (0.46) GPR35GAATHRBKMT2AMEN1
SCHEMBL27587702 0.88 MGLL (0.45) GPR35GAATHRBKMT2AMEN1
SCHEMBL27587723 0.87 MEN1 (0.42) GPR35GAATHRBKMT2AMEN1
SCHEMBL27587711 0.87 GPR35 (0.51) GPR35GAATHRBKMT2AALDH1A1
SCHEMBL6824083 0.85 L3MBTL1 (0.42) GPR35GAATHRBKMT2APOLB
SCHEMBL9488095 0.85 PTGS2 (0.41) GPR35GAATHRBPOLBALDH1A1
SCHEMBL3018832 0.85 MAPT (0.48) GAAKMT2AMEN1NPC1ALDH1A1
SCHEMBL9267193 0.85 GPR35 (0.39) GPR35GAATHRBKMT2AMEN1
SCHEMBL27605684 0.83 MEN1 (0.47) KMT2AMEN1ALDH1A1CXCR1CXCR2
SCHEMBL29967745 0.82 CXCR2 (0.49) GPR35GAATHRBKMT2AMEN1

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
CN-1539816-A IL-8 receptor antagonists ʷ��˿�������ȳ�ķ���޹�˾ 2004-10-27 CN disclosed