SCHEMBL5697696

SCHEMBL5697696

CN1CCN(C(=O)c2ccc(Cl)nc2O)CC1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
TSHR P16473 2/20 0.52
HSP90AA1 P07900 1/20 0.52
TP53 P04637 1/20 0.52
ALOX15 P16050 1/20 0.52
KMT2A Q03164 2/20 0.50
POLB P06746 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.47
KDM4A O75164 1/20 0.46
HRH4 Q9H3N8 6/20 0.46
HRH3 Q9Y5N1 3/20 0.46
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
KDM4E B2RXH2 1/20 0.43
RAB9A P51151 1/20 0.43
HRH1 P35367 1/20 0.43
MAPT P10636 1/20 0.42

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
SCHEMBL5909264 0.83 L3MBTL1 (0.48) LMNATSHRHSP90AA1TP53ALOX15
SCHEMBL17433947 0.76 KMT2A (0.51) LMNATSHRHSP90AA1TP53ALOX15
SCHEMBL9356625 0.74 HSP90AA1 (0.57) LMNATSHRHSP90AA1TP53ALOX15
SCHEMBL23742757 0.74 L3MBTL1 (0.48) LMNATSHRHSP90AA1TP53ALOX15
SCHEMBL31395167 0.74 HRH4 (0.53) LMNATSHRTP53ALOX15KMT2A
SCHEMBL1156444 0.72 LMNA (0.77) LMNATSHRHSP90AA1TP53ALOX15
SCHEMBL21666388 0.72 POLB (0.53) LMNATSHRHSP90AA1TP53ALOX15
SCHEMBL13503827 0.71 KMT2A (0.88) LMNATSHRHSP90AA1TP53ALOX15
SCHEMBL6578719 0.71 POLB (0.60) LMNATSHRHSP90AA1TP53ALOX15
SCHEMBL20327780 0.71 SMN1; SMN2 (0.39) ALOX15KMT2APOLBL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1667990-A2 NEW COMPOUNDS AstraZeneca AB (SE) 2006-06-14 EP disclosed
WO-2005027823-A2 3-HETEROCYCLYL-INDOLE DERIVATIVES AS INHIBITORS OF GLYCOGEN SYNTHASE KINASE-3 (GSK-3) ASTRAZENECA AB (SE) 2005-03-31 WO disclosed