SCHEMBL7092018

SCHEMBL7092018

Nc1ccccc1Oc1c(Cl)cccc1[N+](=O)[O-]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.56
PIN1 Q13526 1/20 0.53
ALDH1A1 P00352 3/20 0.51
MAPT P10636 4/20 0.49
POLB P06746 1/20 0.49
HSPB1 P04792 1/20 0.47
NPC1 O15118 1/20 0.45
RECQL P46063 1/20 0.45
RAB9A P51151 1/20 0.45
KDM4E B2RXH2 1/20 0.44
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
GAA P10253 2/20 0.43
TDP1 Q9NUW8 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
PDE7A Q13946 2/20 0.43
TTR P02766 1/20 0.43
ALB P02768 1/20 0.43

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
SCHEMBL11096653 0.81 KDM4E (0.59) PIN1ALDH1A1MAPTKDM4ECRHBP
SCHEMBL8104832 0.79 HPGD (0.64) HPGDPIN1ALDH1A1MAPTPOLB
SCHEMBL2326248 0.78 MAPT (0.64) HPGDPIN1ALDH1A1MAPTPOLB
SCHEMBL7416255 0.78 HPGD (0.51) HPGDALDH1A1MAPTPOLBHSPB1
SCHEMBL8426532 0.77 KDM4E (0.55) PIN1ALDH1A1MAPTKDM4ECRHBP
SCHEMBL31470065 0.77 HPGD (0.65) HPGDPIN1ALDH1A1MAPTPOLB
SCHEMBL8701801 0.77 HPGD (0.65) HPGDPIN1ALDH1A1MAPTPOLB
SCHEMBL27637801 0.76 TSHR (0.60) HPGDPIN1ALDH1A1MAPTNPC1
SCHEMBL9663613 0.74 TSHR (0.58) HPGDALDH1A1MAPTNPC1RAB9A
SCHEMBL8989557 0.74 HPGD (0.51) HPGDALDH1A1MAPTPOLBHSPB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0585895-B1 Herbicidal compositions RHONE POULENC AGROCHIMIE (FR) 1995-11-08 EP claimed
EP-0585895-A1 Herbicidal compositions RHONE-POULENC AGROCHIMIE (FR) 1994-03-09 EP claimed
JP-6183912-A None JP disclosed
US-20030050193-A1 Herbicide combinations comprising specific sulfonylureas BAYER CROPSCIENCE GMBH (DE) 2003-03-13 US disclosed
EP-0585895-B1 Herbicidal compositions RHONE POULENC AGROCHIMIE (FR) 1995-11-08 EP disclosed
JP-H06183912-A HERBICIDAL COMPOSITION RHONE POULENC AGROCHIM 1994-07-05 JP disclosed
EP-0585895-A1 Herbicidal compositions RHONE-POULENC AGROCHIMIE (FR) 1994-03-09 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-20030050193-A1 Herbicide combinations comprising specific sulfonylureas FOXM1, CCNB3, MSRB3 HPGD 1492/4885PIN1 1896/4885ALDH1A1 219/4885

“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.