SCHEMBL16391552

SCHEMBL16391552

C[C@H]1CNCCN1c1nc2cc(C(F)(F)F)cc(-c3ccccn3)c2o1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 4/20 0.36
▸ LATS1 O95835 1/20 0.35
▸ TRPV1 Q8NER1 1/20 0.35
▸ SPAST Q9UBP0 1/20 0.35
▸ ADORA2A P29274 1/20 0.35
▸ HTR7 P34969 1/20 0.34
▸ GSK3B P49841 4/20 0.34
▸ HTR2A P28223 2/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ CBFB Q13951 1/20 0.34
▸ HTR2B P41595 1/20 0.34
▸ MET P08581 1/20 0.34
▸ FLT3 P36888 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ HPGD P15428 1/20 0.33

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
SCHEMBL17744550 1.00 HTR2C (0.36) HTR2CLATS1TRPV1SPASTADORA2A
SCHEMBL17744559 0.89 LATS1 (0.37) HTR2CLATS1SPASTADORA2AHTR7
SCHEMBL16391959 0.89 LATS1 (0.37) HTR2CLATS1SPASTADORA2AHTR7
SCHEMBL17744480 0.87 LATS1 (0.37) HTR2CLATS1ADORA2AHTR7GSK3B
SCHEMBL16391962 0.87 LATS1 (0.37) HTR2CLATS1ADORA2AHTR7GSK3B
SCHEMBL17744437 0.86 HTR2C (0.39) HTR2CLATS1TRPV1ADORA2AHTR7
SCHEMBL16391595 0.86 HTR2C (0.39) HTR2CLATS1TRPV1ADORA2AHTR7
SCHEMBL16391957 0.84 GSK3B (0.36) HTR2CLATS1ADORA2AHTR7GSK3B
SCHEMBL17744223 0.84 GSK3B (0.36) HTR2CLATS1ADORA2AHTR7GSK3B
SCHEMBL17744540 0.83 HTR2C (0.33) HTR2CLATS1TRPV1SPASTGSK3B

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 15 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-9890142-B2 PDE4 inhibitor MEIJI SEIKA PHARMA CO., LTD. (JP) 2018-02-13 — — US disclosed
US-9850235-B2 — — 2017-12-26 — — 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
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
EP-3020718-A1 NOVEL PDE4 INHIBITOR Meiji Seika Pharma Co., Ltd. (JP) 2016-05-18 — — EP disclosed
WO-2015005429-A1 NOVEL PDE4 INHIBITOR Meiji Seikaファルマ株式会社 (JP) 2015-01-15 — — 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-20160159783-A1 PDE4 Inhibitor PDE4A, PDE4B, PDE3B HTR2C 3334/4885LATS1 4068/4885TRPV1 3440/4885

“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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