SCHEMBL16831533

SCHEMBL16831533

Cc1nnn2cc(Br)ccc12

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 5/20 0.37
▸ TSHR P16473 1/20 0.35
▸ GAA P10253 2/20 0.33
▸ ALDH1A1 P00352 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
SCHEMBL19128887 0.72 CA1 (0.41) GAAALDH1A1
SCHEMBL19128517 0.71 ELANE (0.44) GAAALDH1A1
SCHEMBL20448940 0.64 GAA (0.46) AHRTSHRGAAALDH1A1
SCHEMBL15825111 0.64 GAA (0.38) AHRTSHRGAAALDH1A1
SCHEMBL3664512 0.63 AHR (0.43) AHRTSHRGAAALDH1A1
SCHEMBL20620683 0.62 HPGD (0.42) TSHRGAAALDH1A1
SCHEMBL10809934 0.62 AHR (0.35) AHRTSHRALDH1A1
SCHEMBL30943277 0.61 MEN1 (0.38) AHRALDH1A1
SCHEMBL24567318 0.60 EIF4A3 (0.34) AHRALDH1A1
SCHEMBL22491181 0.60 AHR (0.33) AHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250136592-A1 C-LINKED INHIBITORS OF ENL/AF9 YEATS BRIDGE MEDICINES 2025-05-01 — — US disclosed
US-20190002454-A1 NRF2 Regulators GLAXOSMITHKLINE IP DEV LTD (GB) 2019-01-03 — — US disclosed
US-10144731-B2 Nrf2 regulators GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-12-04 — — US disclosed
US-20160318917-A1 NRF2 REGULATORS ASTEX THERAPEUTICS LIMITED (GB) 2016-11-03 — — US disclosed
US-20160318917-A1 NRF2 REGULATORS ASTEX THERAPEUTICS LIMITED (GB) 2016-11-03 — — US disclosed
US-20160318917-A1 NRF2 REGULATORS ASTEX THERAPEUTICS LIMITED (GB) 2016-11-03 — — US disclosed
EP-3083614-A1 NRF2 REGULATORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2016-10-26 — — EP disclosed
WO-2015092713-A1 NRF2 REGULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2015-06-25 — — WO disclosed
WO-2015092713-A1 NRF2 REGULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2015-06-25 — — WO 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 (4 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 AHR 32/4885TSHR 2353/4885GAA 2667/4885
US-20160318917-A1 NRF2 REGULATORS NFE2L2, KEAP1, NQO1 AHR 32/4885TSHR 2353/4885GAA 2667/4885
US-20250136592-A1 C-LINKED INHIBITORS OF ENL/AF9 YEATS MLLT3, MLLT1, YEATS2 AHR 795/4885TSHR 4121/4885GAA 2786/4885
US-10144731-B2 Nrf2 regulators NFE2L2, KEAP1, NQO1 AHR 32/4885TSHR 2353/4885GAA 2667/4885

“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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