SCHEMBL6234464

SCHEMBL6234464

Cc1cc(C(=O)c2ccc(Cl)cc2)ccc1[N+](=O)[O-]

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.64
VCAM1 P19320 2/20 0.57
MAPT P10636 5/20 0.56
ALDH1A1 P00352 4/20 0.56
TDP1 Q9NUW8 2/20 0.56
MAPK1 P28482 2/20 0.52
LMNA P02545 2/20 0.52
RAF1 P04049 1/20 0.52
HPGD P15428 1/20 0.52
GFER P55789 1/20 0.52
PAX8 Q06710 1/20 0.52
POLB P06746 3/20 0.50
KDM4E B2RXH2 1/20 0.50
HSP90AA1 P07900 1/20 0.50
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
GAA P10253 1/20 0.48
RAB9A P51151 2/20 0.48
ABCC3 O15438 1/20 0.48
ABCC4 O15439 1/20 0.48

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
SCHEMBL28050912 0.90 TSHR (0.77) TSHRVCAM1MAPTALDH1A1TDP1
SCHEMBL25962657 0.88 TSHR (0.64) TSHRVCAM1MAPTALDH1A1TDP1
SCHEMBL5155427 0.86 TSHR (0.66) TSHRVCAM1MAPTALDH1A1TDP1
SCHEMBL5981573 0.86 TSHR (0.71) TSHRVCAM1MAPTALDH1A1TDP1
SCHEMBL18547069 0.84 VCAM1 (0.65) TSHRVCAM1MAPTALDH1A1MAPK1
Acetic Acid SCHEMBL27685581 0.83 TSHR (0.67) TSHRVCAM1MAPTALDH1A1TDP1
Carbamic Acid SCHEMBL28316763 0.82 MAPK1 (0.67) TSHRVCAM1MAPTALDH1A1TDP1
SCHEMBL5151922 0.82 MAPT (0.68) TSHRMAPTALDH1A1TDP1MAPK1
SCHEMBL30409295 0.81 MEN1 (0.73) TSHRMAPTALDH1A1TDP1LMNA
SCHEMBL18547550 0.81 VCAM1 (0.57) TSHRVCAM1MAPTALDH1A1TDP1

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 TSHR 2249/4885VCAM1 4860/4885MAPT 4612/4885

“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.