SCHEMBL21046449

SCHEMBL21046449

O=C1/C(=C/c2ccc(Br)cc2)Oc2cc(O)ccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 1.00
▸ KMT2A Q03164 7/20 1.00
▸ POLB P06746 2/20 1.00
▸ RAB9A P51151 2/20 1.00
▸ MAOB P27338 5/20 0.83
▸ TYR P14679 4/20 0.83
▸ MAOA P21397 3/20 0.83
▸ RECQL P46063 3/20 0.71
▸ KDM4E B2RXH2 2/20 0.71
▸ NPC1 O15118 2/20 0.71
▸ GAA P10253 2/20 0.71
▸ MAPT P10636 2/20 0.71
▸ PSMD14 O00487 1/20 0.71
▸ AURKA O14965 1/20 0.71
▸ DAPK3 O43293 1/20 0.71
▸ JAK2 O60674 1/20 0.71
▸ STK17B O94768 1/20 0.71
▸ ALPL P05186 1/20 0.71
▸ ALPI P09923 1/20 0.71
▸ ALPG P10696 1/20 0.71

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
SCHEMBL29435856 0.91 TYR (1.00) MEN1KMT2APOLBRAB9AMAOB
SCHEMBL5707753 0.91 TYR (1.00) MEN1KMT2APOLBRAB9AMAOB
SCHEMBL30214422 0.91 TYR (1.00) MEN1KMT2APOLBRAB9AMAOB
SCHEMBL28949991 0.87 TYR (0.86) MEN1KMT2APOLBRAB9AMAOB
SCHEMBL30214414 0.87 TYR (0.86) MEN1KMT2APOLBRAB9AMAOB
6-Hydroxy-4'-Chloro Aurone SCHEMBL30214415 0.86 ELANE (0.88) MEN1KMT2APOLBRAB9AMAOB
SCHEMBL30214416 0.86 MAOB (0.83) MEN1KMT2APOLBRAB9AMAOB
SCHEMBL30214402 0.86 MAOB (0.83) MEN1KMT2APOLBRAB9AMAOB
SCHEMBL19462969 0.86 MAOA (0.83) MEN1KMT2APOLBRAB9AMAOB
6-Hydroxy-4'-Chloro Aurone SCHEMBL30214387 0.86 ELANE (0.88) MEN1KMT2APOLBRAB9AMAOB

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-11286245-B2 Therapeutic aurones Middle Tennessee State University (US) 2022-03-29 — — US disclosed
US-20210053933-A1 THERAPEUTIC AURONES Middle Tennessee State University (US) 2021-02-25 — — US disclosed
US-20210053933-A1 THERAPEUTIC AURONES Middle Tennessee State University (US) 2021-02-25 — — US disclosed
US-10899727-B2 Therapeutic aurones Middle Tennessee State University (US) 2021-01-26 — — US disclosed
US-20200399238-A1 THERAPEUTIC AURONES Middle Tennessee State University (US) 2020-12-24 — — US disclosed
US-20200399238-A1 THERAPEUTIC AURONES Middle Tennessee State University (US) 2020-12-24 — — US disclosed
WO-2020223439-A1 AURONES AND METHODS OF USING AURONES TO TREAT TUBERCULOSIS Middle Tennessee State University (US) 2020-11-05 — — WO disclosed
US-20190169151-A1 THERAPEUTIC AURONES Middle Tennessee State University (US) 2019-06-06 — — US disclosed
US-20190169151-A1 THERAPEUTIC AURONES Middle Tennessee State University (US) 2019-06-06 — — 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 (5 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-10899727-B2 Therapeutic aurones AURKA, PIGS, PRF1 MEN1 2702/4885KMT2A 2551/4885POLB 4280/4885
US-20200399238-A1 THERAPEUTIC AURONES AURKA, PIGS, PRF1 MEN1 2702/4885KMT2A 2551/4885POLB 4280/4885
US-11286245-B2 Therapeutic aurones AURKA, PIGS, PRF1 MEN1 2702/4885KMT2A 2551/4885POLB 4280/4885
US-20210053933-A1 THERAPEUTIC AURONES AURKA, PIGS, PRF1 MEN1 2702/4885KMT2A 2551/4885POLB 4280/4885
US-20190169151-A1 THERAPEUTIC AURONES AURKA, PIGS, PRF1 MEN1 2702/4885KMT2A 2551/4885POLB 4280/4885

“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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