SCHEMBL4268322

SCHEMBL4268322

O=c1cc(-c2ccc(OCc3ccccc3)cc2)oc2cc(OCc3ccccc3)cc(OCc3ccccc3)c12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 1.00
▸ MAPT P10636 2/20 0.70
▸ ABCB1 P08183 1/20 0.70
▸ PPARG P37231 2/20 0.70
▸ ABCG2 Q9UNQ0 2/20 0.68
▸ BCHE P06276 1/20 0.67
▸ ACHE P22303 1/20 0.67
▸ PLG P00747 3/20 0.64
▸ ELANE P08246 2/20 0.64
▸ CREB1 P16220 1/20 0.58
▸ CYP1A2 P05177 2/20 0.56
▸ CYP1A1 P04798 1/20 0.56
▸ CYP1B1 Q16678 1/20 0.56
▸ KDM4E B2RXH2 2/20 0.55
▸ ALDH1A1 P00352 2/20 0.55
▸ POLB P06746 2/20 0.55
▸ CYP2C9 P11712 2/20 0.55
▸ HPGD P15428 2/20 0.55
▸ CYP2C19 P33261 2/20 0.55
▸ CYP3A4 P08684 1/20 0.55

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
SCHEMBL17523234 0.90 BCHE (0.82) L3MBTL1MAPTABCB1PPARGABCG2
SCHEMBL29979584 0.89 L3MBTL1 (0.79) L3MBTL1MAPTABCB1PPARGABCG2
SCHEMBL27963408 0.87 L3MBTL1 (0.77) L3MBTL1MAPTABCB1PPARGABCG2
SCHEMBL19267888 0.87 L3MBTL1 (0.77) L3MBTL1MAPTABCB1PPARGABCG2
SCHEMBL30376090 0.87 L3MBTL1 (0.77) L3MBTL1MAPTABCB1PPARGABCG2
SCHEMBL4145144 0.85 L3MBTL1 (0.73) L3MBTL1MAPTABCB1PPARGABCG2
SCHEMBL8066758 0.84 L3MBTL1 (0.72) L3MBTL1MAPTABCB1PPARGABCG2
SCHEMBL13741293 0.84 L3MBTL1 (0.71) L3MBTL1MAPTABCB1PPARGABCG2
SCHEMBL5792042 0.83 MAPT (0.91) L3MBTL1MAPTABCB1PPARGABCG2
SCHEMBL738489 0.83 MEN1 (0.71) L3MBTL1ABCB1ABCG2ACHECYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7605241-B2 Synthesis of inhibitors of p90Rsk UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2009-10-20 — — US disclosed
US-7605241-B2 Synthesis of inhibitors of p90Rsk UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2009-10-20 — — US disclosed
US-20080269144-A1 Synthesis of Inhibitors of P90Rsk UNIVERSITY OF VIRGINIA PATENT FOUNDATION 2008-10-30 — — US disclosed
US-20080269144-A1 Synthesis of Inhibitors of P90Rsk UNIVERSITY OF VIRGINIA PATENT FOUNDATION 2008-10-30 — — 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-20080269144-A1 Synthesis of Inhibitors of P90Rsk RAF1, KSR1, STK10 L3MBTL1 1916/4885MAPT 4264/4885ABCB1 1319/4885

“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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