SCHEMBL2906602

SCHEMBL2906602

O=C(O)N1CCC[C@H]1CNc1nc(Cl)ncc1N(O)O

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 3/20 0.34
▸ DPP4 P27487 7/20 0.33
▸ CYP2D6 P10635 6/20 0.33
▸ DPP8 Q6V1X1 6/20 0.33
▸ DPP9 Q86TI2 6/20 0.33
▸ DPP7 Q9UHL4 6/20 0.33
▸ JAK3 P52333 2/20 0.33
▸ CSF1R P07333 1/20 0.33
▸ TRPV1 Q8NER1 1/20 0.33
▸ HCRTR1 O43613 2/20 0.31
▸ HCRTR2 O43614 1/20 0.31
▸ GRM5 P41594 1/20 0.31
▸ LTA4H P09960 1/20 0.31
▸ KMT2A Q03164 1/20 0.30
▸ KAT2B Q92831 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
SCHEMBL18440370 0.86 TNK2 (0.39) BTKDPP4CYP2D6DPP8DPP9
SCHEMBL1190088 0.86 PRMT5 (0.41) TRPV1
SCHEMBL27987045 0.83 TNK2 (0.38) BTKCSF1RHCRTR1HCRTR2GRM5
SCHEMBL28814728 0.83 TNK2 (0.38) BTKCSF1RHCRTR1HCRTR2GRM5
SCHEMBL27987039 0.83 TNK2 (0.38) BTKCSF1RHCRTR1HCRTR2GRM5
SCHEMBL15056902 0.72 STK17B (0.51) TRPV1KMT2A
SCHEMBL16336962 0.72 STK17B (0.51) TRPV1KMT2A
SCHEMBL16337923 0.72 STK17B (0.51) TRPV1KMT2A
SCHEMBL15056838 0.72 PRMT5 (0.43) TRPV1
SCHEMBL15056219 0.72 PRMT5 (0.43) TRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2217226-B1 PEPTIDE DEFORMYLASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2015-07-22 — — EP disclosed
US-20130045962-A1 PEPTIDE DEFORMYLASE INHIBITORS GLAXOSMITHKLINE LLC 2013-02-21 — — US disclosed
EP-2217226-A1 PEPTIDE DEFORMYLASE INHIBITORS GlaxoSmithKline LLC (US) 2010-08-18 — — EP disclosed
US-20090306066-A1 PEPTIDE DEFORMYLASE INHIBITORS GLAXOSMITHKLINE LLC 2009-12-10 — — US disclosed
WO-2009061879-A1 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-05-14 — — 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 (2 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-20130045962-A1 PEPTIDE DEFORMYLASE INHIBITORS PDF, DPEP1, DHPS BTK 2950/4885DPP4 67/4885CYP2D6 1998/4885
US-20090306066-A1 PEPTIDE DEFORMYLASE INHIBITORS PDF, DHPS, PADI3 BTK 2400/4885DPP4 180/4885CYP2D6 2051/4885

“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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