SCHEMBL17002845

SCHEMBL17002845

COC(=O)c1cc([C@@H]2C[C@H]2C(=O)OC(C)(C)C)ccc1OC

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 8/20 0.49
▸ KDM1A O60341 5/20 0.44
▸ TRPM5 Q9NZQ8 2/20 0.39
▸ APP P05067 1/20 0.39
▸ LTB4R Q15722 1/20 0.38
▸ SLC6A2 P23975 1/20 0.38
▸ SLC6A4 P31645 1/20 0.38
▸ SLC6A3 Q01959 1/20 0.38

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
SCHEMBL17002842 1.00 PDE4B (0.49) PDE4BKDM1ATRPM5APPLTB4R
SCHEMBL30394598 1.00 PDE4B (0.49) PDE4BKDM1ATRPM5APPLTB4R
SCHEMBL17002809 0.85 ALDH1A1 (0.41) PDE4BKDM1A
SCHEMBL17002812 0.85 ALDH1A1 (0.41) PDE4BKDM1A
SCHEMBL25289489 0.84 CA1 (0.46) PDE4BKDM1AAPP
SCHEMBL30457311 0.84 CA1 (0.46) PDE4BKDM1AAPP
SCHEMBL17003034 0.83 KDM1A (0.48) PDE4BKDM1ATRPM5APPLTB4R
SCHEMBL17003032 0.83 KDM1A (0.48) PDE4BKDM1ATRPM5APPLTB4R
SCHEMBL17002757 0.81 KDM1A (0.56) PDE4BKDM1A
SCHEMBL17002758 0.81 KDM1A (0.56) PDE4BKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2907802-B1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2019-08-07 — — EP disclosed
US-9751885-B2 Cyclopropanamine compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-09-05 — — US disclosed
US-20150266881-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-09-24 — — US disclosed
EP-2907802-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2015-08-19 — — 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-20150266881-A1 CYCLOPROPANAMINE COMPOUND AND USE THEREOF BHMT, HNMT, KDM1A PDE4B 1570/4885KDM1A 3/4885TRPM5 3955/4885

“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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