SCHEMBL27587702

SCHEMBL27587702

NC(=O)N(c1ccccc1)c1ccc([N+](=O)[O-])cc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.45
CXCR1 P25024 4/20 0.45
CXCR2 P25025 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
HCRTR1 O43613 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
ALDH1A1 P00352 4/20 0.44
ATM Q13315 2/20 0.44
GPR35 Q9HC97 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
TLR9 Q9NR96 1/20 0.44
GAA P10253 1/20 0.43
THRB P10828 1/20 0.43
KCNMA1 Q12791 1/20 0.42
TSHR P16473 2/20 0.41

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 0.92 GPR35 (0.46) SMN1; SMN2LMNAMAPTALDH1A1ATM
SCHEMBL27605684 0.89 MEN1 (0.47) CXCR1CXCR2SMN1; SMN2ALDH1A1MEN1
SCHEMBL27556186 0.89 SMN1; SMN2 (0.47) MGLLCXCR1CXCR2SMN1; SMN2HCRTR1
SCHEMBL27587711 0.88 GPR35 (0.51) CXCR1CXCR2SMN1; SMN2LMNAMAPT
SCHEMBL28750622 0.88 MGLL (0.50) MGLLCXCR1CXCR2SMN1; SMN2HCRTR1
SCHEMBL27587720 0.88 GPR35 (0.43) CXCR1CXCR2SMN1; SMN2MAPTALDH1A1
SCHEMBL6824083 0.86 L3MBTL1 (0.42) SMN1; SMN2MAPTALDH1A1GPR35KMT2A
SCHEMBL27587723 0.86 MEN1 (0.42) CXCR1CXCR2LMNAMAPTALDH1A1
SCHEMBL28099896 0.85 KMT2A (0.51) MGLLSMN1; SMN2LMNAMAPTALDH1A1
SCHEMBL27605657 0.84 GPR35 (0.49) MGLLCXCR1CXCR2SMN1; SMN2MAPT

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