SCHEMBL6239901

SCHEMBL6239901

Cc1cc(C2(C(F)(F)F)CC(c3ccc(F)cc3)=NO2)ccc1N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.42
TDP1 Q9NUW8 2/20 0.39
ABL1 P00519 1/20 0.39
RIN1 Q13671 1/20 0.39
POLB P06746 1/20 0.38
PKM P14618 1/20 0.38
APAF1 O14727 1/20 0.35
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
MAPT P10636 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SSTR5 P35346 3/20 0.32
NLRP3 Q96P20 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
HPGD P15428 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31

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
SCHEMBL6240469 0.90 RECQL (0.39) HTTTDP1PKMALDH1A1CYP3A4
SCHEMBL6238076 0.87 HTT (0.31) HTTTDP1ALDH1A1CYP3A4TSHR
SCHEMBL6242894 0.86 PTGS2 (0.37)
SCHEMBL6237513 0.81 S100B (0.33) TDP1ALDH1A1CYP3A4TSHRHPGD
SCHEMBL3035865 0.81 HTT (0.43) HTTTDP1ABL1RIN1POLB
SCHEMBL740175 0.81 TDP1 (0.36) HTTTDP1ABL1RIN1PKM
SCHEMBL29530772 0.81 TDP1 (0.36) HTTTDP1ABL1RIN1PKM
SCHEMBL6238373 0.80 RECQL (0.38) HTTTDP1PKMALDH1A1CYP3A4
SCHEMBL1611209 0.77 HTT (0.41) HTTTDP1ABL1RIN1POLB
SCHEMBL1610695 0.77 HTT (0.39) HTTTDP1ABL1RIN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050250822-A1 Substituted benzanilide compound and noxious organism controlling agent NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2005-11-10 US disclosed
EP-1538138-A1 SUBSTITUTED BENZANILIDE COMPOUND AND PEST CONTROL AGENT NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 2005-06-08 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-20050250822-A1 Substituted benzanilide compound and noxious organism controlling agent GCN1, L3MBTL3, L3MBTL4 HTT 2820/4885TDP1 3916/4885ABL1 643/4885

“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.