SCHEMBL29409810

SCHEMBL29409810

COc1cc(OCc2ccccc2)c2c(ccc3cc(OCc4ccccc4)ccc32)c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.55
▸ MAOB P27338 1/20 0.52
▸ PDGFRB P09619 1/20 0.46
▸ PDGFRA P16234 1/20 0.46
▸ FLT3 P36888 1/20 0.46
▸ HDAC8 Q9BY41 1/20 0.46
▸ ABCB1 P08183 3/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ HTR1A P08908 1/20 0.43
▸ DRD2 P14416 1/20 0.43
▸ P2RY14 Q15391 1/20 0.43

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
SCHEMBL21582171 0.91 ALOX5 (0.56) ALOX5MAOBPDGFRBPDGFRAFLT3
SCHEMBL13744712 0.87 MAOB (0.54) ALOX5MAOBPDGFRBPDGFRAHDAC8
SCHEMBL4077230 0.84 MTNR1A (0.47) ALOX5MAOBPDGFRBPDGFRAABCB1
SCHEMBL27489226 0.80 MAOB (0.53) ALOX5MAOBPDGFRBPDGFRAHDAC8
SCHEMBL19612377 0.78 ALOX5 (0.58) ALOX5MAOBPDGFRBPDGFRAFLT3
SCHEMBL19612485 0.77 ALOX5 (0.65) ALOX5MAOBPDGFRBPDGFRAFLT3
SCHEMBL19612478 0.77 ALOX5 (0.65) ALOX5MAOBPDGFRBPDGFRAFLT3
SCHEMBL1359254 0.77 MAOB (0.50) ALOX5MAOBPDGFRBPDGFRAFLT3
SCHEMBL2090976 0.75 MAOB (0.62) ALOX5MAOBPDGFRBPDGFRAHDAC8
SCHEMBL18623122 0.75 MAOB (0.62) ALOX5MAOBPDGFRBPDGFRAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11583507-B2 Direct AMPK activator compounds SOCIETE DES PRODUITS NESTLE S.A. (CH) 2023-02-21 — — US disclosed
EP-3968976-A1 PHENANTHRENE AMPK ACTIVATOR COMPOUNDS, COMPOSITIONS, METHODS AND USES THEREOF Société des Produits Nestlé S.A. (CH) 2022-03-23 — — EP disclosed
US-20220062199-A1 PHENANTHRENE AMPK ACTIVATOR COMPOUNDS, COMPOSITIONS, METHODS AND USES THEREOF NESTLE SA (CH) 2022-03-03 — — 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 (2 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-11583507-B2 Direct AMPK activator compounds PRKAG2, AK2, PRKAG3 ALOX5 1849/4885MAOB 3811/4885PDGFRB 3223/4885
US-20220062199-A1 PHENANTHRENE AMPK ACTIVATOR COMPOUNDS, COMPOSITIONS, METHODS AND USES THEREOF PRKAG2, PRKAG1, PRKAG3 ALOX5 3491/4885MAOB 3790/4885PDGFRB 2227/4885

“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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