SCHEMBL1679907

SCHEMBL1679907

COc1cc([N+](=O)[O-])c(C(=O)OCc2ccccc2)cc1Oc1ccc2c(c1)OC(F)(F)C(F)(F)O2

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.40
LMNA P02545 2/20 0.40
PKM P14618 1/20 0.40
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
CTSV O60911 1/20 0.37
CTSL P07711 1/20 0.37
ALDH1A1 P00352 2/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL1679975 0.88 MEN1 (0.44) L3MBTL1MEN1KMT2AMAPTLMNA
SCHEMBL1679945 0.86 TDP1 (0.47) L3MBTL1MEN1KMT2AMAPTKDM4E
SCHEMBL1679942 0.83 POLB (0.41) L3MBTL1MEN1KMT2AMAPTKDM4E
SCHEMBL1679895 0.82 LMNA (0.40) L3MBTL1MEN1KMT2AMAPTKDM4E
SCHEMBL1781038 0.79 MEN1 (0.44) L3MBTL1MEN1KMT2AMAPTKDM4E
SCHEMBL29729282 0.78 MEN1 (0.54) L3MBTL1MEN1KMT2AMAPTKDM4E
SCHEMBL874114 0.78 MEN1 (0.54) L3MBTL1MEN1KMT2AMAPTKDM4E
SCHEMBL2089147 0.78 MEN1 (0.54) L3MBTL1MEN1KMT2AMAPTKDM4E
SCHEMBL1679898 0.77 TDP1 (0.47) L3MBTL1MEN1KMT2AMAPTKDM4E
SCHEMBL12310509 0.76 ALDH1A1 (0.54) L3MBTL1MEN1KMT2AMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2305649-B1 METHOD FOR PRODUCING 6-ARYLOXYQUINOLINE DERIVATIVE AND INTERMEDIATE THEREOF NIPPON KAYAKU KK (JP) 2013-04-24 EP disclosed
US-8367833-B2 Process for producing 6-aryloxyquinoline derivative and intermediate therefor NIPPON KAYAKU CO., LTD. (JP) 2013-02-05 US disclosed
US-20110118468-A1 PROCESS FOR PRODUCING 6-ARYLOXYQUINOLINE DERIVATIVE AND INTERMEDIATE THEREFOR MITSUI CHEMICALS CROP & LIFE SOLUTIONS, INC. (JP) 2011-05-19 US disclosed
EP-2305649-A1 METHOD FOR PRODUCING 6-ARYLOXYQUINOLINE DERIVATIVE AND INTERMEDIATE THEREOF Nippon Kayaku Co., Ltd. (JP) 2011-04-06 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110118468-A1 PROCESS FOR PRODUCING 6-ARYLOXYQUINOLINE DERIVATIVE AND INTERMEDIATE THEREFOR FAR1, CYP4F11, WEE2 L3MBTL1 4063/4885MEN1 2109/4885KMT2A 902/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.