SCHEMBL16391306

SCHEMBL16391306

C[C@H]1CNCCN1c1nc2cc(Cl)cc(-c3ccc(F)cn3)c2o1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 2/20 0.36
▸ HTR2C P28335 5/20 0.36
▸ HTR2A P28223 3/20 0.36
▸ HTR2B P41595 3/20 0.36
▸ LATS1 O95835 1/20 0.36
▸ ROCK2 O75116 1/20 0.35
▸ ALK Q9UM73 3/20 0.35
▸ WEE1 P30291 4/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ ATR Q13535 1/20 0.34
▸ ATRIP Q8WXE1 1/20 0.34
▸ MET P08581 1/20 0.34
▸ PIM1 P11309 2/20 0.34
▸ PIM3 Q86V86 2/20 0.34
▸ PIM2 Q9P1W9 2/20 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
SCHEMBL17744535 1.00 P2RX7 (0.36) P2RX7HTR2CHTR2AHTR2BLATS1
SCHEMBL17744261 0.92 HTR2C (0.43) HTR2CHTR2AHTR2BLATS1ROCK2
SCHEMBL16392031 0.92 HTR2C (0.43) HTR2CHTR2AHTR2BLATS1ROCK2
SCHEMBL17744249 0.87 HTR2C (0.44) HTR2CHTR2AHTR2BLATS1ROCK2
SCHEMBL16391381 0.87 HTR2C (0.44) HTR2CHTR2AHTR2BLATS1ROCK2
SCHEMBL17744437 0.85 HTR2C (0.39) HTR2CHTR2ALATS1WEE1
SCHEMBL16391595 0.85 HTR2C (0.39) HTR2CHTR2ALATS1WEE1
SCHEMBL16391541 0.84 HTR2C (0.37) HTR2CHTR2AHTR2BLATS1ROCK2
SCHEMBL17744520 0.84 HTR2C (0.37) HTR2CHTR2AHTR2BLATS1ROCK2
SCHEMBL16391540 0.84 LATS1 (0.37) HTR2CHTR2AHTR2BLATS1ROCK2

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 17 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-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-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
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
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 P2RX7 2516/4885HTR2C 3334/4885HTR2A 3249/4885

“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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