SCHEMBL17002758

SCHEMBL17002758

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

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 11/20 0.56
▸ MAOB P27338 2/20 0.50
▸ MAOA P21397 1/20 0.50
▸ PDE4B Q07343 4/20 0.49
▸ MTNR1A P48039 2/20 0.41
▸ MTNR1B P49286 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ DPP4 P27487 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
SCHEMBL17002757 1.00 KDM1A (0.56) KDM1AMAOBMAOAPDE4BMTNR1A
SCHEMBL17003706 0.91 KDM1A (0.56) KDM1AMAOBMAOAPDE4BMTNR1A
SCHEMBL17003707 0.91 KDM1A (0.56) KDM1AMAOBMAOAPDE4BMTNR1A
SCHEMBL17002684 0.86 KDM1A (0.56) KDM1AMAOBMAOAPDE4B
SCHEMBL17002687 0.86 KDM1A (0.56) KDM1AMAOBMAOAPDE4B
SCHEMBL30394598 0.81 PDE4B (0.49) KDM1APDE4B
SCHEMBL17002845 0.81 PDE4B (0.49) KDM1APDE4B
SCHEMBL17002842 0.81 PDE4B (0.49) KDM1APDE4B
SCHEMBL24890658 0.80 KDM1A (0.67) KDM1AMAOBMAOAPDE4BKDM4E
SCHEMBL17002866 0.80 KDM1A (0.67) KDM1AMAOBMAOAPDE4BKDM4E

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 KDM1A 3/4885MAOB 27/4885MAOA 21/4885

“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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