SCHEMBL17744261

SCHEMBL17744261

CC1CNCCN1c1nc2cc(Cl)cc(-c3ccc(Cl)cn3)c2o1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 3/20 0.43
▸ HTR2A P28223 1/20 0.43
▸ HTR2B P41595 1/20 0.43
▸ WEE1 P30291 4/20 0.37
▸ LATS1 O95835 1/20 0.37
▸ KCNH2 Q12809 1/20 0.36
▸ PIM1 P11309 2/20 0.35
▸ PIM3 Q86V86 2/20 0.35
▸ PIM2 Q9P1W9 2/20 0.35
▸ GSK3B P49841 4/20 0.34
▸ ROCK2 O75116 1/20 0.34
▸ ROCK1 Q13464 1/20 0.34
▸ USP7 Q93009 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
SCHEMBL16392031 1.00 HTR2C (0.43) HTR2CHTR2AHTR2BWEE1LATS1
SCHEMBL16391306 0.92 P2RX7 (0.36) HTR2CHTR2AHTR2BWEE1LATS1
SCHEMBL17744535 0.92 P2RX7 (0.36) HTR2CHTR2AHTR2BWEE1LATS1
SCHEMBL16391595 0.87 HTR2C (0.39) HTR2CHTR2AWEE1LATS1GSK3B
SCHEMBL17744437 0.87 HTR2C (0.39) HTR2CHTR2AWEE1LATS1GSK3B
SCHEMBL16391540 0.86 LATS1 (0.37) HTR2CHTR2AHTR2BWEE1LATS1
SCHEMBL17744299 0.86 LATS1 (0.37) HTR2CHTR2AHTR2BWEE1LATS1
SCHEMBL17744577 0.84 PRPS1 (0.36) HTR2CWEE1LATS1GSK3BROCK2
SCHEMBL16391450 0.84 PRPS1 (0.36) HTR2CWEE1LATS1GSK3BROCK2
SCHEMBL17744652 0.83 LATS1 (0.35) HTR2CWEE1LATS1KCNH2GSK3B

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 HTR2C 3334/4885HTR2A 3249/4885HTR2B 1922/4885

“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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