SCHEMBL29301459

SCHEMBL29301459

Cc1cncc(Br)c1[N+](=O)[O-]

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ TSHR P16473 2/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ GRIN2D O15399 2/20 0.36
▸ GRIN3B O60391 2/20 0.36
▸ GRIN1 Q05586 2/20 0.36
▸ GRIN2A Q12879 2/20 0.36
▸ GRIN2B Q13224 2/20 0.36
▸ GRIN2C Q14957 2/20 0.36
▸ GRIN3A Q8TCU5 2/20 0.36
▸ GAA P10253 1/20 0.34
▸ MAPT P10636 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ HSD17B10 Q99714 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
SCHEMBL12835616 0.85 MAPT (0.36) ALDH1A1TDP1TSHRGRIN2DGRIN3B
SCHEMBL4633923 0.85 ALDH1A1 (0.56) ALDH1A1TDP1TSHRGRIN2DGRIN3B
SCHEMBL29735720 0.83 ALDH1A1 (0.54) ALDH1A1TDP1TSHRGRIN2DGRIN3B
SCHEMBL19765250 0.76 ALDH1A1 (0.42) ALDH1A1TDP1TSHRGRIN2DGRIN3B
SCHEMBL31553067 0.76 ALDH1A1 (0.42) ALDH1A1TDP1TSHRGRIN2DGRIN3B
SCHEMBL31481303 0.76 ALDH1A1 (0.42) ALDH1A1TDP1TSHRGRIN2DGRIN3B
SCHEMBL29071382 0.76 GPR35 (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL17555458 0.76 ALDH1A1 (0.36) ALDH1A1TDP1MAPTNPC1RAB9A
SCHEMBL31553016 0.76 MAPT (0.36) TDP1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL951700 0.72 CYP1A2 (0.44) ALDH1A1TDP1TSHRCYP1A2GAA

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-20240228504-A1 SUBSTITUTED TRICYCLIC AMIDES, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2024-07-11 — — 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-20240228504-A1 SUBSTITUTED TRICYCLIC AMIDES, ANALOGUES THEREOF, AND METHODS USING SAME SLC10A1, NR1H4, SLC10A2 ALDH1A1 3140/4885TDP1 1264/4885TSHR 1793/4885

“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.

Send feedback