SCHEMBL17744223

SCHEMBL17744223

CC1CNCCN1c1nc2cc(C#N)cc(-c3ccccn3)c2o1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 4/20 0.36
▸ GRM5 P41594 6/20 0.36
▸ HTR2C P28335 3/20 0.36
▸ LATS1 O95835 1/20 0.36
▸ ADORA2A P29274 1/20 0.35
▸ HTR7 P34969 1/20 0.35
▸ METAP2 P50579 1/20 0.34
▸ METAP1 P53582 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
SCHEMBL16391957 1.00 GSK3B (0.36) GSK3BGRM5HTR2CLATS1ADORA2A
SCHEMBL16391959 0.88 LATS1 (0.37) GSK3BGRM5HTR2CLATS1ADORA2A
SCHEMBL16391962 0.88 LATS1 (0.37) GSK3BHTR2CLATS1ADORA2AHTR7
SCHEMBL17744480 0.88 LATS1 (0.37) GSK3BHTR2CLATS1ADORA2AHTR7
SCHEMBL17744559 0.88 LATS1 (0.37) GSK3BGRM5HTR2CLATS1ADORA2A
SCHEMBL16391595 0.87 HTR2C (0.39) GSK3BHTR2CLATS1ADORA2AHTR7
SCHEMBL17744437 0.87 HTR2C (0.39) GSK3BHTR2CLATS1ADORA2AHTR7
SCHEMBL17744550 0.84 HTR2C (0.36) GSK3BHTR2CLATS1ADORA2AHTR7
SCHEMBL16391552 0.84 HTR2C (0.36) GSK3BHTR2CLATS1ADORA2AHTR7
SCHEMBL16391580 0.84 GSK3B (0.34) GSK3BHTR2CLATS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3020718-B1 NOVEL PDE4 INHIBITOR MEIJI SEIKA PHARMA CO LTD (JP) 2018-12-26 — — EP claimed
US-9890142-B2 PDE4 inhibitor MEIJI SEIKA PHARMA CO., LTD. (JP) 2018-02-13 — — US claimed
US-9850235-B2 — — 2017-12-26 — — US claimed
US-20160159783-A1 PDE4 Inhibitor MEIJI SEIKA PHARMA CO., LTD. (JP) 2016-06-09 — — US claimed
EP-3020718-A1 NOVEL PDE4 INHIBITOR Meiji Seika Pharma Co., Ltd. (JP) 2016-05-18 — — EP claimed
EP-3020718-B1 NOVEL PDE4 INHIBITOR MEIJI SEIKA PHARMA CO LTD (JP) 2018-12-26 — — EP disclosed
US-9890142-B2 PDE4 inhibitor MEIJI SEIKA PHARMA CO., LTD. (JP) 2018-02-13 — — US disclosed
US-9850235-B2 — — 2017-12-26 — — US disclosed
US-20160159783-A1 PDE4 Inhibitor MEIJI SEIKA PHARMA CO., LTD. (JP) 2016-06-09 — — US disclosed
EP-3020718-A1 NOVEL PDE4 INHIBITOR Meiji Seika Pharma Co., Ltd. (JP) 2016-05-18 — — EP 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-20160159783-A1 PDE4 Inhibitor PDE4A, PDE4B, PDE3B GSK3B 832/4885GRM5 3427/4885HTR2C 3334/4885

“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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