SCHEMBL24716112

SCHEMBL24716112

Nc1cccc(N=O)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.47
NPC1 O15118 3/20 0.41
RAB9A P51151 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
GAA P10253 1/20 0.41
TSHR P16473 3/20 0.37
ALOX15 P16050 3/20 0.37
ALDH1A1 P00352 5/20 0.35
CYP3A4 P08684 3/20 0.35
TDP1 Q9NUW8 3/20 0.35
HPGD P15428 2/20 0.35
HSD17B10 Q99714 2/20 0.35
HSP90AA1 P07900 1/20 0.34
SMN1; SMN2 Q16637 4/20 0.33
AKR1C3 P42330 1/20 0.33
AKR1C2 P52895 1/20 0.33
AKR1C1 Q04828 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
PIK3CA P42336 1/20 0.33

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
SCHEMBL14140385 0.83 HSP90AA1 (0.41) MMP2NPC1RAB9AL3MBTL1GAA
SCHEMBL7191141 0.79 MMP2 (0.34) MMP2NPC1RAB9AL3MBTL1ALOX15
SCHEMBL8520219 0.76 L3MBTL1 (0.44) MMP2NPC1RAB9AL3MBTL1GAA
SCHEMBL3078969 0.76 LMNA (0.52) MMP2NPC1RAB9AL3MBTL1GAA
SCHEMBL143318 0.75
SCHEMBL6558400 0.74 GAA (0.42) MMP2NPC1RAB9AL3MBTL1GAA
SCHEMBL1172644 0.74
SCHEMBL16511527 0.74 MMP2 (0.44) MMP2NPC1RAB9AL3MBTL1GAA
SCHEMBL22060026 0.73 JAK2 (0.47) NPC1RAB9AL3MBTL1GAATSHR
SCHEMBL7991021 0.73 G6PD (0.47) MMP2NPC1RAB9AL3MBTL1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022253152-A1 7-NITRO-8-HYDROXYQUINOLINE DERIVATIVE, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF 江苏亚虹医药科技股份有限公司 2022-12-08 WO disclosed
CN-102077060-B Monitoring system based on corrosion metal G. PATEL (US) 2014-10-29 CN disclosed
CN-102077060-A Monitoring system based on corrosion metal PATEL G 2011-05-25 CN disclosed