SCHEMBL20617544

SCHEMBL20617544

Nc1ccc(Br)c(Cl)c1N=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ POLB P06746 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ HTT P42858 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ APEX1 P27695 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ BLM P54132 1/20 0.32
▸ MCL1 Q07820 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ HTR2A P28223 1/20 0.32
▸ HTR2C P28335 1/20 0.32
▸ HTR2B P41595 1/20 0.32
▸ CA12 O43570 2/20 0.31
▸ CA1 P00915 2/20 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
SCHEMBL5278996 0.74 THRB (0.38) MEN1MAPTKMT2AHTTTHRB
SCHEMBL10992080 0.72 ALDH1A1 (0.39) MEN1ALDH1A1POLBMAPTKMT2A
SCHEMBL31387674 0.70 PTGER4 (0.43) MEN1ALDH1A1POLBMAPTKMT2A
SCHEMBL239457 0.70 PTGER4 (0.43) MEN1ALDH1A1POLBMAPTKMT2A
SCHEMBL10990726 0.70 ALDH1A1 (0.36) MEN1ALDH1A1POLBMAPTKMT2A
SCHEMBL24052991 0.70 CYP3A4 (0.35) MEN1ALDH1A1POLBMAPTKMT2A
SCHEMBL18840671 0.69 AXL (0.30) —
SCHEMBL767268 0.69 ALDH1A1 (0.44) MEN1ALDH1A1POLBMAPTKMT2A
SCHEMBL14741415 0.67 PTGER4 (0.33) MEN1ALDH1A1POLBMAPTKMT2A
SCHEMBL159571 0.67 PTGER4 (0.33) MEN1ALDH1A1POLBMAPTKMT2A

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-20190002454-A1 NRF2 Regulators GLAXOSMITHKLINE IP DEV LTD (GB) 2019-01-03 — — 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-20190002454-A1 NRF2 Regulators NFE2L2, KEAP1, NQO1 MEN1 4800/4885ALDH1A1 799/4885POLB 1963/4885

“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