SCHEMBL7997074

SCHEMBL7997074

Cn1c(=O)cc(O)c2ccc([N+](=O)[O-])cc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.56
ALDH1A1 P00352 2/20 0.56
HPGD P15428 2/20 0.56
THRB P10828 2/20 0.56
NPSR1 Q6W5P4 2/20 0.56
KDM4E B2RXH2 1/20 0.56
HSD17B10 Q99714 1/20 0.56
GPR35 Q9HC97 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
CYP1A2 P05177 1/20 0.43
GAA P10253 1/20 0.42
HIF1A Q16665 1/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
TDP1 Q9NUW8 1/20 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
SCHEMBL7708920 0.80 MAPT (0.67) MAPTALDH1A1NPSR1SMN1; SMN2TSHR
SCHEMBL7989106 0.79 MAPT (0.47) MAPTALDH1A1HPGDNPSR1KDM4E
SCHEMBL11825468 0.74 ALDH1A1 (0.62) MAPTALDH1A1HPGDTHRBNPSR1
SCHEMBL17576255 0.74 MAPT (0.63) MAPTALDH1A1NPSR1KDM4ESMN1; SMN2
SCHEMBL7988381 0.73 HTT (0.42) MAPTALDH1A1NPSR1KDM4EMAPK1
SCHEMBL17505200 0.73 MAPT (0.51) MAPTALDH1A1NPSR1KDM4ESMN1; SMN2
SCHEMBL7988582 0.73 ALDH1A1 (0.45) MAPTALDH1A1HPGDNPSR1KDM4E
SCHEMBL8001349 0.73 CYP19A1 (0.40) MAPTALDH1A1HPGDNPSR1KDM4E
SCHEMBL17673673 0.73 MAPT (0.77) MAPTALDH1A1NPSR1HSD17B10SMN1; SMN2
SCHEMBL18928573 0.73 MAPT (0.82) MAPTALDH1A1HPGDNPSR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1158265-C Quinoline ketone derivant and antianaphylaction using same as active substance ���ձ���ī��ѧ��ҵ��ʽ���� 2004-07-21 CN disclosed
CN-1095834-C Quinolinone derivatives and antiallergic agent containing said quinolinone derivatives as active ingredient DAINIPPON INK & CHEMICALS (JP) 2002-12-11 CN disclosed
CN-1275564-A Quinoline ketone derivant and antianaphylaction using same as active substance DAINIPPON INK & CHEMICALS (JP) 2000-12-06 CN disclosed
US-6114352-A Quinolinone derivative and anti-allergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-09-05 US disclosed
EP-0785190-B1 Quinolinone derivative and antiallergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK & CHEMICALS (JP) 2000-08-16 EP disclosed
US-5942521-A Quinolinone derivative and anti-allergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-08-24 US disclosed
CN-1163268-A Quinolinone derivatives and antiallergic agent containing said quinolinone derivatives as active ingredient LAINIPPON INK AND CHEMICALC IN (JP) 1997-10-29 CN disclosed
EP-0785190-A2 Quinolinone derivative and antiallergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 1997-07-23 EP disclosed