SCHEMBL20581393

SCHEMBL20581393

CC(=NNC(=O)OC(C)(C)C)c1cnc(Cl)nc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ MAPT P10636 3/20 0.49
▸ RAB9A P51151 10/20 0.49
▸ NPC1 O15118 9/20 0.49
▸ SMN1; SMN2 Q16637 5/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ HTT P42858 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ STK17B O94768 1/20 0.41
▸ STK17A Q9UEE5 1/20 0.41
▸ LMNA P02545 2/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ MIF P14174 1/20 0.37
▸ GAA P10253 3/20 0.36
▸ TRPA1 O75762 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ ATR Q13535 1/20 0.36
▸ TP53 P04637 1/20 0.35

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
SCHEMBL20581090 1.00 L3MBTL1 (0.50) L3MBTL1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL10801436 0.81 L3MBTL1 (0.54) L3MBTL1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL20582091 0.79 MAPT (0.43) L3MBTL1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL20581110 0.78 L3MBTL1 (0.51) L3MBTL1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL20581109 0.78 L3MBTL1 (0.51) L3MBTL1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL10805983 0.77 L3MBTL1 (0.65) L3MBTL1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL21431899 0.76 L3MBTL1 (0.55) L3MBTL1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL20583911 0.75 GAA (0.61) L3MBTL1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL20583909 0.75 GAA (0.61) L3MBTL1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL29544846 0.75 GAA (0.61) L3MBTL1MAPTRAB9ANPC1SMN1; SMN2

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-12247031-B2 Cyclobutyl pyrazolopyrimidine PDE9 inhibitors MERCK SHARP & DOHME LLC (US) 2025-03-11 — — US disclosed
EP-3893881-B1 CYCLOBUTYL PYRAZOLOPYRIMIDINE PDE9 INHIBITORS MERCK SHARP & DOHME LLC (US) 2024-10-09 — — EP disclosed
EP-3634964-B1 PYRAZOLOPYRIMIDINE PDE9 INHIBITORS MERCK SHARP & DOHME (US) 2022-02-23 — — EP disclosed
US-20220017525-A1 CYCLOBUTYL PYRAZOLOPYRIMIDINE PDE9 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2022-01-20 — — US disclosed
US-11028092-B2 Substituted pyrazolo[3,4-d]pyrimidines as PDE9 inhibitors MERCK SHARP & DOHME CORP. (US) 2021-06-08 — — US disclosed
US-10934294-B2 Substituted pyrazolo[3,4-d]pyrimidines as PDE9 inhibitors MERCK SHARP & DOHME CORP. (US) 2021-03-02 — — US disclosed
US-20200140445-A1 PYRAZOLOPYRIMIDINE PDE9 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2020-05-07 — — US disclosed
US-20180354955-A1 PYRAZOLOPYRIMIDINE PDE9 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2018-12-13 — — 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 (6 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-10934294-B2 Substituted pyrazolo[3,4-d]pyrimidines as PDE9 inhibitors PDE9A, PDE5A, PDE4D L3MBTL1 4551/4885MAPT 1894/4885RAB9A 52/4885
US-20200140445-A1 PYRAZOLOPYRIMIDINE PDE9 INHIBITORS PDE9A, PDE5A, PDE2A L3MBTL1 4575/4885MAPT 2036/4885RAB9A 60/4885
US-20220017525-A1 CYCLOBUTYL PYRAZOLOPYRIMIDINE PDE9 INHIBITORS PDE9A, PDE5A, PDE3B L3MBTL1 4207/4885MAPT 2144/4885RAB9A 69/4885
US-11028092-B2 Substituted pyrazolo[3,4-d]pyrimidines as PDE9 inhibitors PDE9A, PDE5A, PDE4D L3MBTL1 4551/4885MAPT 1894/4885RAB9A 52/4885
US-12247031-B2 Cyclobutyl pyrazolopyrimidine PDE9 inhibitors PDE9A, PDE5A, PDE3B L3MBTL1 4207/4885MAPT 2144/4885RAB9A 69/4885
US-20180354955-A1 PYRAZOLOPYRIMIDINE PDE9 INHIBITORS PDE9A, PDE5A, PDE12 L3MBTL1 4279/4885MAPT 2290/4885RAB9A 87/4885

“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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