SCHEMBL1679925

SCHEMBL1679925

Cc1cc([N+](=O)[O-])c(C(=O)OCc2ccccc2)cc1Oc1ccc(OC(F)(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 3/20 0.40
EIF4E P06730 1/20 0.40
MEN1 O00255 2/20 0.39
PPARD Q03181 2/20 0.39
PDE1C Q14123 1/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MRGPRX4 Q96LA9 2/20 0.39
RAB9A P51151 1/20 0.39
PPARG P37231 1/20 0.38

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
SCHEMBL1679874 0.90 MAPT (0.40) MAPTCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL1679941 0.87 USP10 (0.44) MAPTSMN1; SMN2NPSR1KMT2AALDH1A1
SCHEMBL1781038 0.83 MEN1 (0.44) MAPTKMT2AALDH1A1MEN1CYP3A4
SCHEMBL1679937 0.83 TDP1 (0.50) MAPTCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL15314942 0.81 ALDH1A1 (0.50) MAPTSMN1; SMN2NPSR1KMT2AALDH1A1
SCHEMBL1679943 0.80 KMT2A (0.40) MAPTCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL12114417 0.79 HPSE (0.48) MAPTCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL14138486 0.76 L3MBTL1 (0.55) MAPTKMT2AALDH1A1MEN1PDE1C
SCHEMBL1679929 0.76 KMT2A (0.44) CYP1A2CYP2C9CYP2C19SMN1; SMN2NPSR1
SCHEMBL20897393 0.76 CTSV (0.52) MAPTKMT2AALDH1A1MEN1TDP1

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 MAPT 4340/4885CYP1A2 46/4885CYP2C9 170/4885

“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.