SCHEMBL3265220

SCHEMBL3265220

CCOC(=O)CC(=O)N(Cc1ccc(Br)cc1)C1=C(C(=O)OC)COC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ TDP1 Q9NUW8 1/20 0.36
▸ MME P08473 1/20 0.36
▸ ACE P12821 1/20 0.36
▸ TP53 P04637 2/20 0.36
▸ KMT2A Q03164 3/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ HTT P42858 1/20 0.35
▸ MAPT P10636 4/20 0.35
▸ MAPK1 P28482 3/20 0.34
▸ HPGD P15428 1/20 0.34
▸ CHRM2 P08172 2/20 0.33
▸ CHRM1 P11229 2/20 0.33
▸ CHRM3 P20309 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ CTDSP1 Q9GZU7 1/20 0.33
▸ S1PR4 O95977 1/20 0.33
▸ S1PR1 P21453 1/20 0.33

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
SCHEMBL17629532 0.87 ALDH1A1 (0.37) ALDH1A1MAPTNPSR1KDM4ELTB4R2
SCHEMBL17629493 0.83 ALDH1A1 (0.37) LMNAALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL17629533 0.78 TRPM2 (0.36) ALDH1A1KMT2AMEN1MAPTNPSR1
SCHEMBL3265221 0.76 MME (0.35) LMNAALDH1A1TDP1MMEACE
SCHEMBL3776799 0.75 MAPK1 (0.46) LMNAALDH1A1TDP1KMT2ASMN1; SMN2
SCHEMBL17629556 0.70 PPARG (0.35) MAPTCHRM2CHRM1CHRM3
SCHEMBL3778231 0.67 KMT2A (0.41) LMNAALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL27787074 0.65 MAPT (0.56) LMNAALDH1A1TDP1TP53KMT2A
SCHEMBL4150824 0.65 MAPK8 (0.49) LMNAALDH1A1KMT2ASMN1; SMN2HTT
SCHEMBL31384678 0.64 ACHE (0.39) LMNAALDH1A1SMN1; SMN2HTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8471024-B2 Tetrahydrofuropyridones MERCK SHARP & DOHME, CORP. (US) 2013-06-25 — — US disclosed
US-8471024-B2 Tetrahydrofuropyridones MERCK SHARP & DOHME, CORP. (US) 2013-06-25 — — US disclosed
US-8471024-B2 Tetrahydrofuropyridones MERCK SHARP & DOHME, CORP. (US) 2013-06-25 — — US disclosed
EP-2257170-B1 TETRAHYDROFUROPYRIDONES MERCK SHARP & DOHME (US) 2012-12-26 — — EP disclosed
US-20100331358-A1 TETRAHYDROFUROPYRIDONES MERCK SHARP & DOHME LLC 2010-12-30 — — US disclosed
US-20100331358-A1 TETRAHYDROFUROPYRIDONES MERCK SHARP & DOHME LLC 2010-12-30 — — US disclosed
EP-2257170-A1 TETRAHYDROFUROPYRIDONES Merck Sharp & Dohme Corp. (US) 2010-12-08 — — EP disclosed
WO-2009108496-A1 TETRAHYDROFUROPYRIDONES MERCK & CO., INC. (US) 2009-09-03 — — 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 (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-20100331358-A1 TETRAHYDROFUROPYRIDONES HIF1AN, EGLN3, HIF1A LMNA 4636/4885ALDH1A1 167/4885TDP1 3756/4885

“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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