SCHEMBL5697692

SCHEMBL5697692

CCN(CC)Cc1ccc(Cl)nc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.46
KDM4E B2RXH2 2/20 0.46
MEN1 O00255 2/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPT P10636 2/20 0.46
KMT2A Q03164 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
THRB P10828 1/20 0.46
APEX1 P27695 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
RECQL P46063 1/20 0.46
CACNA1B Q00975 1/20 0.46
APBA1 Q02410 1/20 0.46
MCL1 Q07820 1/20 0.46
HKDC1 Q2TB90 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PRKCI P41743 1/20 0.43
ACHE P22303 1/20 0.42
JAK2 O60674 1/20 0.40

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
SCHEMBL6141771 0.84 TLR7 (0.35) POLBKDM4EMEN1ALDH1A1MAPT
SCHEMBL6142118 0.73 HSD17B3 (0.40) MEN1KMT2AHDAC6
SCHEMBL15990329 0.72 PDXK (0.35) KDM4EMEN1ALDH1A1KMT2AHTT
SCHEMBL6142244 0.72 PYCR1 (0.44) KDM4EMEN1ALDH1A1KMT2AHTT
SCHEMBL13675363 0.72 POLB (0.60) POLBKDM4EMEN1ALDH1A1MAPT
SCHEMBL6141679 0.70 CHEK1 (0.49) POLBKDM4EMEN1ALDH1A1MAPT
SCHEMBL6141786 0.68 KDM4E (0.53) POLBKDM4EMEN1ALDH1A1MAPT
SCHEMBL5249119 0.67 AKR1B1 (0.44) POLBKDM4EMEN1ALDH1A1MAPT
SCHEMBL28972155 0.67 PRKCI (0.65) POLBKDM4EMEN1ALDH1A1MAPT
SCHEMBL11266199 0.65 GABRA1 (0.56) POLBKDM4EMEN1ALDH1A1MAPT

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