SCHEMBL13082340

SCHEMBL13082340

Bc1ccc2c(c1)Oc1cc(Br)ccc1N2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 5/20 0.47
▸ ALOX5 P09917 2/20 0.38
▸ TGM2 P21980 1/20 0.34
▸ CES1 P23141 1/20 0.34
▸ CA12 O43570 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CA4 P22748 1/20 0.34
▸ CA7 P43166 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ LMNA P02545 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ HTT P42858 1/20 0.32
▸ BLM P54132 1/20 0.32
▸ SNCA P37840 1/20 0.31
▸ PDPK1 O15530 1/20 0.31
▸ JAK2 O60674 1/20 0.31
▸ HTR2B P41595 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALPL P05186 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
SCHEMBL1985922 0.88 AHR (0.58) AHRALOX5TGM2CES1CA12
SCHEMBL29689592 0.88 AHR (0.58) AHRALOX5TGM2CES1CA12
Benzene SCHEMBL28149598 0.84 AHR (0.54) AHRALOX5TGM2CES1CA12
SCHEMBL46736 0.81 AHR (0.56) AHRALOX5TGM2CES1CA12
SCHEMBL13833013 0.79 ALOX5 (0.65) AHRALOX5LMNAMAPTHTR2B
SCHEMBL30839233 0.79 ALOX5 (0.65) AHRALOX5LMNAMAPTHTR2B
SCHEMBL28731967 0.74 AHR (0.47) AHRALOX5
SCHEMBL19417332 0.71 AHR (0.44) AHRLMNAMAPTHTTBLM
SCHEMBL10171010 0.70 TGM2 (0.54) AHRTGM2CES1CA12CA1
SCHEMBL30869584 0.70 AHR (0.42) AHRALOX5TGM2CES1CA12

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-7842823-B2 Fluorogenic probes for reactive oxygen species THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-11-30 — — US disclosed
US-20070141658-A1 Fluorogenic probes for reactive oxygen species THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-06-21 — — 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-20070141658-A1 Fluorogenic probes for reactive oxygen species PRDX1, GPX1, GPX4 AHR 1219/4885ALOX5 905/4885TGM2 3448/4885

“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.

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