SCHEMBL3602573

SCHEMBL3602573

O=C(O)N1CCC(Oc2cccc(CO)n2)CC1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.43
EPHX2 P34913 2/20 0.40
BTK Q06187 1/20 0.40
KCNH2 Q12809 1/20 0.39
FFAR4 Q5NUL3 7/20 0.39
KMT2A Q03164 1/20 0.38
LOXL2 Q9Y4K0 2/20 0.38
GPR119 Q8TDV5 2/20 0.37
IKBKB O14920 1/20 0.36
CHUK O15111 1/20 0.36
NAMPT P43490 1/20 0.36

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
SCHEMBL3610594 0.88 LOXL2 (0.44) EPHX2BTKKCNH2FFAR4KMT2A
SCHEMBL27111204 0.83 GPR119 (0.56) HRH3GPR119
SCHEMBL29826100 0.83 GPR119 (0.56) HRH3GPR119
SCHEMBL5266382 0.82 HRH3 (0.46) HRH3EPHX2BTKKCNH2FFAR4
SCHEMBL3602342 0.82 GPR119 (0.39) HRH3EPHX2BTKKCNH2FFAR4
SCHEMBL3602535 0.81 HRH3 (0.37) HRH3EPHX2BTKKCNH2FFAR4
SCHEMBL5270350 0.81 HCRTR1 (0.44) EPHX2BTKKCNH2KMT2AGPR119
SCHEMBL5267084 0.81 EPHX2 (0.41) EPHX2BTKKCNH2FFAR4LOXL2
SCHEMBL4129398 0.80 KCNH2 (0.45) EPHX2KCNH2LOXL2GPR119
SCHEMBL4208660 0.78 EPHX2 (0.43) HRH3EPHX2IKBKBCHUK

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-7723331-B2 Thienopyrimidine compounds and uses thereof ASTRAZENECA AB (SE) 2010-05-25 US disclosed
EP-2121703-A1 THIENOPYRIMIDIN-4-ONE AND THIENOPYRIDAZIN-7-ONE DERIVATIVES AS MCH RL ANTAGONISTS AstraZeneca AB (SE) 2009-11-25 EP disclosed
US-20080051405-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-02-28 US disclosed
WO-2008020799-A1 THIENOPYRIMIDIN-4-ONE AND THIENOPYRIDAZIN-7-ONE DERIVATIVES AS MCH RL ANTAGONISTS ASTRAZENECA AB (SE) 2008-02-21 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-20080051405-A1 Therapeutic Agents GPR119, HTT, IAPP HRH3 1346/4885EPHX2 1731/4885BTK 4510/4885

“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.