SCHEMBL4059188

SCHEMBL4059188

CN1CCN(C(=O)c2ccnc(Cl)c2)CC1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.59
KMT2A Q03164 3/20 0.55
MEN1 O00255 2/20 0.55
HPGD P15428 3/20 0.54
TSHR P16473 2/20 0.54
PROKR1 Q8TCW9 1/20 0.52
ALOX15 P16050 2/20 0.50
ALDH1A1 P00352 2/20 0.50
GFER P55789 1/20 0.50
LMNA P02545 1/20 0.50
TP53 P04637 1/20 0.50
MAPT P10636 1/20 0.48
MAPKAPK2 P49137 1/20 0.47
KDM4E B2RXH2 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL6179175 0.86 PROKR1 (0.53) KMT2AMEN1HPGDTSHRPROKR1
SCHEMBL939096 0.85 PROKR1 (0.63) KMT2AMEN1HPGDPROKR1ALDH1A1
SCHEMBL937205 0.85 PROKR1 (0.63) KMT2AMEN1HPGDPROKR1ALDH1A1
SCHEMBL30667713 0.84 PROKR1 (0.61) KMT2AMEN1HPGDTSHRPROKR1
SCHEMBL1859158 0.84 PROKR1 (0.61) KMT2AMEN1HPGDTSHRPROKR1
SCHEMBL7496576 0.84 SMN1; SMN2 (0.49) POLBKMT2AMEN1HPGDTSHR
SCHEMBL1862840 0.84 CHRNA7 (0.57) PROKR1GFER
SCHEMBL7235339 0.83 PROKR1 (0.51) KMT2AMEN1HPGDPROKR1ALDH1A1
SCHEMBL9451146 0.83 KMT2A (0.56) POLBKMT2AMEN1HPGDTSHR
SCHEMBL6578719 0.82 POLB (0.60) POLBKMT2AMEN1HPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1961748-A2 2-hydroxy-3-heteroarylindole derivatives as GSK3 inhibitors AstraZeneca AB (SE) 2008-08-27 EP claimed
US-20050153987-A1 Compounds ASTRAZENECA AB (SE) 2005-07-14 US claimed
EP-1492785-A1 NEW COMPOUNDS AstraZeneca AB (SE) 2005-01-05 EP claimed
WO-2003082853-A1 NEW COMPOUNDS ASTRAZENECA AB (SE) 2003-10-09 WO claimed
EP-1492785-B9 2-HYDROXY-3-HETEROARYLINDOLE DERIVATIVES AS GSK3 INHIBITORS ASTRAZENECA AB (SE) 2009-10-21 EP disclosed
US-20090149460-A1 New Compounds BERG STEFAN 2009-06-11 US disclosed
EP-1492785-B1 2-HYDROXY-3-HETEROARYLINDOLE DERIVATIVES AS GSK3 INHIBITORS ASTRAZENECA AB (SE) 2008-12-03 EP disclosed
EP-1961748-A2 2-hydroxy-3-heteroarylindole derivatives as GSK3 inhibitors AstraZeneca AB (SE) 2008-08-27 EP disclosed
US-7399780-B2 3-Heterocyclyl-indole inhibitors of glycogen synthase kinase-3 ASTRAZENECA AB (SE) 2008-07-15 US disclosed
US-20050153987-A1 Compounds ASTRAZENECA AB (SE) 2005-07-14 US disclosed
EP-1492785-A1 NEW COMPOUNDS AstraZeneca AB (SE) 2005-01-05 EP disclosed
WO-2003082853-A1 NEW COMPOUNDS ASTRAZENECA AB (SE) 2003-10-09 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-20090149460-A1 New Compounds SDHA, CYP11B2, SERPINB1 POLB 1474/4885KMT2A 4694/4885MEN1 1000/4885
US-20050153987-A1 Compounds SDHA, CYP11B2, CYP11B1 POLB 1833/4885KMT2A 4483/4885MEN1 868/4885

“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.