SCHEMBL9386232

SCHEMBL9386232

O=[N+]([O-])c1c[c]c(Cl)cc1F

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.46
ATM Q13315 1/20 0.46
ALDH1A1 P00352 5/20 0.40
HIF1A Q16665 2/20 0.40
TSHR P16473 2/20 0.39
CYP3A4 P08684 2/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
TXNRD1 Q16881 1/20 0.39
TXNRD3 Q86VQ6 1/20 0.39
TXNRD2 Q9NNW7 1/20 0.39
VCAM1 P19320 4/20 0.38
ESPL1 Q14674 1/20 0.38
MAPK1 P28482 1/20 0.37
GPR35 Q9HC97 2/20 0.36
MAPT P10636 2/20 0.34
POLB P06746 1/20 0.34
EPAS1 Q99814 1/20 0.33
TTR P02766 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
SCHEMBL7749473 0.85 ALDH1A1 (0.44) TDP1ATMALDH1A1HIF1ATSHR
SCHEMBL7228772 0.82 TSHR (0.41) TDP1ALDH1A1HIF1ATSHRCYP3A4
SCHEMBL1531096 0.80 TDP1 (0.48) TDP1ATMALDH1A1HIF1ATSHR
SCHEMBL6501572 0.80 TSHR (0.48) TDP1ALDH1A1HIF1ATSHRCYP3A4
SCHEMBL11449422 0.77 MAPT (0.41) TDP1ALDH1A1TSHRCYP3A4HPGD
SCHEMBL13836301 0.77 TDP1 (0.46) TDP1ATMALDH1A1HIF1ATSHR
SCHEMBL7481399 0.77 TDP1 (0.46) TDP1ATMALDH1A1HIF1ATSHR
SCHEMBL909526 0.76 TSHR (0.44) TDP1ALDH1A1HIF1ATSHRCYP3A4
SCHEMBL7744893 0.73 TSHR (0.46) TDP1ATMALDH1A1HIF1ATSHR
SCHEMBL6152635 0.73 TSHR (0.43) TDP1ALDH1A1TSHRCYP3A4MAPK1

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
EP-3339286-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2018-06-27 EP disclosed
EP-2427426-B1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2018-02-07 EP disclosed
WO-2013092942-A1 USE OF AMINOBENZAMIDE DERIVATIVES FOR CONTROLLING ANIMAL PARASITES SYNGENTA PARTICIPATIONS AG (CH) 2013-06-27 WO disclosed
US-20120295907-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, LLC (US) 2012-11-22 US disclosed
WO-1994021597-A1 ANILINE DERIVATIVE AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1994-09-29 WO disclosed
EP-0202169-B1 NEW PYRAZOLE DERIVATIVES, THEIR PRODUCTION AND USES HOKKO CHEMICAL INDUSTRY CO., LTD (JP) 1992-11-19 EP disclosed
CN-87100152-A The compound of weeding 1987-08-12 CN disclosed
EP-0202169-A1 New pyrazole derivatives, their production and uses HOKKO CHEMICAL INDUSTRY CO., LTD (JP) 1986-11-20 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-20120295907-A1 INSECTICIDAL COMPOUNDS ACHE, AADAC, BCHE TDP1 4282/4885ATM 3640/4885ALDH1A1 331/4885

“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.