SCHEMBL3582878

SCHEMBL3582878

O=C1NC(=O)C(c2cn[nH]c2)N1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ LMNA P02545 1/20 0.42
▸ GAA P10253 1/20 0.39
▸ TSHR P16473 2/20 0.33
▸ RGS12 O14924 1/20 0.31
▸ BACE1 P56817 1/20 0.31
▸ KCNH2 Q12809 1/20 0.30
▸ ADORA2B P29275 1/20 0.30
▸ KDM1A O60341 1/20 0.30
▸ MAOA P21397 1/20 0.30

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
SCHEMBL14466750 1.00 TDP1 (0.49) TDP1ALDH1A1MAPTLMNAGAA
SCHEMBL13527924 0.73 TDP1 (0.80) TDP1ALDH1A1MAPTLMNAGAA
SCHEMBL17622810 0.69 TDP1 (0.61) TDP1ALDH1A1MAPTLMNAGAA
SCHEMBL31738422 0.68 TDP1 (0.66) TDP1ALDH1A1MAPTLMNAGAA
SCHEMBL395878 0.68 TDP1 (0.66) TDP1ALDH1A1MAPTLMNAGAA
SCHEMBL19955179 0.68 TDP1 (0.66) TDP1ALDH1A1MAPTLMNAGAA
SCHEMBL13948377 0.68 TDP1 (0.46) TDP1ALDH1A1MAPTLMNAGAA
SCHEMBL11533786 0.68 TDP1 (0.50) TDP1ALDH1A1MAPTGAATSHR
SCHEMBL22440147 0.68 HSD11B1 (0.30) —
SCHEMBL7167731 0.67 TDP1 (0.69) TDP1ALDH1A1MAPTLMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100168106-A1 Amino-5-(5-membered)heteroarylimidazolone Compounds And The Use Thereof For Beta-secretase Modulation WYETH LLC (US) 2010-07-01 — — US disclosed
US-7705030-B2 Amino-5-(5-membered)hetero-arylimidazolone compounds and the use thereof for β-secretase modulation WYETH LLC (US) 2010-04-27 — — US disclosed
US-20080306091-A1 AMINO-5-(5-MEMBERED)HETERO-ARYLIMIDAZOLONE COMPOUNDS AND THE USE THEREOF FOR beta-SECRETASE MODULATION WYETH (US) 2008-12-11 — — US disclosed
US-7417047-B2 Amino-5-(5-membered)hetero-arylimidazolone compounds and the use thereof for β-secretase modulation WYETH (US) 2008-08-26 — — US disclosed
EP-1896454-A1 AMlNO-5-(5-MEMBERED)HETEROARYLIMIDAZOLONE COMPOUNDS AND THE USE THEREOF FOR -SECRETASE MODULATION Wyeth a Corporation of the State of Delaware (US) 2008-03-12 — — EP disclosed
WO-2007005366-A1 AMlNO-5-(5-MEMBERED)HETEROARYLIMIDAZOLONE COMPOUNDS AND THE USE THEREOF FOR β-SECRETASE MODULATION WYETH (US) 2007-01-11 — — WO disclosed
US-20070004786-A1 Amino-5-(5-membered)hetero-arylimidazolone compounds and the use thereof for beta-secretase modulation WYETH (US) 2007-01-04 — — 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 (3 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-20070004786-A1 Amino-5-(5-membered)hetero-arylimidazolone compounds and the use thereof for beta-secretase modulation BACE1, BACE2, APP TDP1 839/4885ALDH1A1 2693/4885MAPT 23/4885
US-20080306091-A1 AMINO-5-(5-MEMBERED)HETERO-ARYLIMIDAZOLONE COMPOUNDS AND THE USE THEREOF FOR beta-SECRETASE MODULATION BACE1, BACE2, APP TDP1 839/4885ALDH1A1 2693/4885MAPT 23/4885
US-20100168106-A1 Amino-5-(5-membered)heteroarylimidazolone Compounds And The Use Thereof For Beta-secretase Modulation BACE1, BACE2, APP TDP1 604/4885ALDH1A1 3365/4885MAPT 20/4885

“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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