SCHEMBL20475492

SCHEMBL20475492

O=C(O)N1CCN(c2ccc(O)cn2)CC1=O

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ME2 P23368 13/20 0.49
▸ ME1 P48163 13/20 0.49
▸ ME3 Q16798 13/20 0.49
▸ DRD4 P21917 1/20 0.37
▸ DEGS1 O15121 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ OPRM1 P35372 1/20 0.35
▸ OPRD1 P41143 1/20 0.35
▸ OPRK1 P41145 1/20 0.35
▸ OGFRL1 Q5TC84 1/20 0.35
▸ HSD11B1 P28845 1/20 0.34
▸ ESR1 P03372 1/20 0.34
▸ ESR2 Q92731 1/20 0.34
▸ AKR1C3 P42330 1/20 0.34

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
SCHEMBL15205402 0.84 AKR1C3 (0.50) ME2ME1ME3NPC1RAB9A
SCHEMBL29521781 0.81 ME2 (0.44) ME2ME1ME3ESR2
SCHEMBL20475487 0.81 ME2 (0.44) ME2ME1ME3ESR2
SCHEMBL21551525 0.77 ME2 (0.66) ME2ME1ME3DRD4AKR1C3
SCHEMBL20475499 0.76 DGAT1 (0.38) NPC1RAB9AKMT2AOPRM1HSD11B1
SCHEMBL20956381 0.72 TRPV1 (0.48) OPRM1OPRD1OPRK1OGFRL1
SCHEMBL29576128 0.70 ME2 (0.60) ME2ME1ME3
SCHEMBL1977631 0.69 LMNA (0.56) ME2ME1ME3DEGS1KMT2A
SCHEMBL17987101 0.68 FYN (0.54) ME2ME1ME3RAB9A
SCHEMBL28956353 0.68 ME2 (0.55) ME2ME1ME3DRD4DEGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3582780-B1 AMINO PYRIMIDINE COMPOUNDS USEFUL AS SSAO INHIBITORS LILLY CO ELI (US) 2021-10-13 — — EP disclosed
US-10471060-B2 Amino pyrimidine compounds useful as SSAO inhibitors ELI LILLY AND COMPANY (US) 2019-11-12 — — US disclosed
US-20190275041-A1 AMINO PYRIMIDINE COMPOUNDS USEFUL AS SSAO INHIBITORS ELI LILLY AND COMPANY (US) 2019-09-12 — — US disclosed
US-10278970-B2 Amino pyrimidine compounds useful as SSAO inhibitors ELI LILLY AND COMPANY (US) 2019-05-07 — — US disclosed
US-20180296560-A1 AMINO PYRIMIDINE COMPOUNDS USEFUL AS SSAO INHIBITORS ELI LILLY AND COMPANY 2018-10-18 — — US disclosed
WO-2018151985-A1 AMINO PYRIMIDINE COMPOUNDS USEFUL AS SSAO INHIBITORS ELI LILLY AND COMPANY (US) 2018-08-23 — — 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 (4 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-10278970-B2 Amino pyrimidine compounds useful as SSAO inhibitors DPYD, TYMP, NUDT1 ME2 1907/4885ME1 2147/4885ME3 1683/4885
US-20180296560-A1 AMINO PYRIMIDINE COMPOUNDS USEFUL AS SSAO INHIBITORS DPYD, TYMP, NUDT1 ME2 1907/4885ME1 2147/4885ME3 1683/4885
US-10471060-B2 Amino pyrimidine compounds useful as SSAO inhibitors DPYD, TYMP, NUDT1 ME2 1907/4885ME1 2147/4885ME3 1683/4885
US-20190275041-A1 AMINO PYRIMIDINE COMPOUNDS USEFUL AS SSAO INHIBITORS DPYD, TYMP, NUDT1 ME2 1907/4885ME1 2147/4885ME3 1683/4885

“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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