SCHEMBL6760464

SCHEMBL6760464

CC(C)(N)CNc1c([N+](=O)[O-])cnc2cc(Br)ccc12

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.43
EGFR P00533 8/20 0.37
FBP1 P09467 1/20 0.36
MAPT P10636 1/20 0.34
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL3862496 0.89 PTGES (0.41) PTGESEGFRFBP1MAPTALDH1A1
SCHEMBL3863828 0.86 PTGES (0.39) PTGESEGFRFBP1MAPTALDH1A1
SCHEMBL3863821 0.86 PTGES (0.39) PTGESEGFRFBP1MAPTALDH1A1
SCHEMBL30074835 0.84 PTGES (0.44) PTGESEGFRFBP1MAPTALDH1A1
SCHEMBL20475933 0.84 PTGES (0.44) PTGESEGFRFBP1MAPTALDH1A1
SCHEMBL1043132 0.83 MEN1 (0.41) EGFRMAPTALDH1A1
SCHEMBL6106000 0.81 PTGES (0.36) PTGESEGFRFBP1MAPTALDH1A1
SCHEMBL6106006 0.81 PTGES (0.36) PTGESEGFRFBP1MAPTALDH1A1
SCHEMBL1490815 0.81 MAPT (0.44) PTGESEGFRFBP1MAPTALDH1A1
SCHEMBL204085 0.81 KAT2B (0.43) PTGESEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040147543-A1 Aryl substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2004-07-29 US 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-20040147543-A1 Aryl substituted imidazoquinolines IL2, IFNG, IRF3 PTGES 296/4885EGFR 3216/4885FBP1 3395/4885

“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.