SCHEMBL17144874

SCHEMBL17144874

c1cc(C2NCC3(CC3)CO2)cc(CN2CCCn3ccnc3C2)n1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PDE7B Q9NP56 1/20 0.33
▸ CXCR4 P61073 1/20 0.30

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
SCHEMBL17144960 0.78 GRM2 (0.34) PDE7B
SCHEMBL17144820 0.70 CXCR4 (0.41) PDE7BCXCR4
SCHEMBL17145009 0.69 CXCR4 (0.35) PDE7BCXCR4
SCHEMBL17144722 0.68 KDM4C (0.56) —
SCHEMBL19741663 0.66 KDM4C (0.56) —
SCHEMBL17144910 0.65 JMJD6 (0.42) —
SCHEMBL17145118 0.64 JMJD6 (0.46) —
SCHEMBL16292512 0.61 CHRM2 (0.33) —
SCHEMBL17144777 0.61 KDM4C (0.58) PDE7B
SCHEMBL14837570 0.55 SIGMAR1 (0.52) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170369444-A1 INHIBITORS OF HISTONE DEMETHYLASES EPITHERAPEUTICS APS (DK) 2017-12-28 — — US disclosed
EP-3126345-A1 INHIBITORS OF HISTONE DEMETHYLASES Gilead Sciences, Inc. (US) 2017-02-08 — — EP disclosed
WO-2015153498-A1 INHIBITORS OF HISTONE DEMETHYLASES EPITHERAPEUTICS, APS (DK) 2015-10-08 — — 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-20170369444-A1 INHIBITORS OF HISTONE DEMETHYLASES KDM1B, KDM3A, KDM1A PDE7B 1692/4885CXCR4 4368/4885

“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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