SCHEMBL28544101

SCHEMBL28544101

COC(=O)c1ccnc2cc(N)ccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.51
KDM4E B2RXH2 6/20 0.46
ALDH1A1 P00352 4/20 0.46
GLA P06280 2/20 0.46
PSMD14 O00487 1/20 0.46
LMNA P02545 1/20 0.41
MAPT P10636 3/20 0.41
TP53 P04637 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NQO2 P16083 2/20 0.41
HSD17B10 Q99714 3/20 0.41
HPGD P15428 2/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
ATM Q13315 1/20 0.41
CFTR P13569 1/20 0.40
ABL1 P00519 1/20 0.40
SLC40A1 Q9NP59 2/20 0.39
ALOX15 P16050 2/20 0.39

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
SCHEMBL22492354 0.88 KDM4E (0.54) GAAKDM4EALDH1A1GLAPSMD14
Hydrochloric Acid SCHEMBL32685626 0.87 KDM4E (0.52) GAAKDM4EALDH1A1GLAPSMD14
Hydrochloric Acid SCHEMBL31139660 0.87 KDM4E (0.52) GAAKDM4EALDH1A1GLAPSMD14
SCHEMBL19643044 0.83 NR4A2 (0.50) KDM4EGLAPSMD14LMNAMAPT
SCHEMBL19643450 0.83 CA12 (0.51) GAAKDM4EALDH1A1GLAPSMD14
SCHEMBL30717956 0.82 L3MBTL1 (0.51) GAAKDM4EALDH1A1PSMD14LMNA
SCHEMBL2747240 0.82 LMNA (0.58) KDM4ELMNA
SCHEMBL1998421 0.82 L3MBTL1 (0.51) GAAKDM4EALDH1A1PSMD14LMNA
SCHEMBL31153486 0.82 GAK (0.47) KDM4EPSMD14LMNA
SCHEMBL27040317 0.81 LMNA (0.49) GAAKDM4EALDH1A1PSMD14LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112500341-B Synthesis method of 7-hydroxyquinoline-4-carboxylic acid 苏州康润医药有限公司 2022-04-12 CN claimed
CN-112500341-A Synthesis method of 7-hydroxyquinoline-4-carboxylic acid 苏州康润医药有限公司 2021-03-16 CN claimed
CN-112500341-B Synthesis method of 7-hydroxyquinoline-4-carboxylic acid 苏州康润医药有限公司 2022-04-12 CN disclosed
CN-112500341-B Synthesis method of 7-hydroxyquinoline-4-carboxylic acid 苏州康润医药有限公司 2022-04-12 CN disclosed
CN-112500341-A Synthesis method of 7-hydroxyquinoline-4-carboxylic acid 苏州康润医药有限公司 2021-03-16 CN disclosed
CN-112500341-A Synthesis method of 7-hydroxyquinoline-4-carboxylic acid 苏州康润医药有限公司 2021-03-16 CN disclosed