SCHEMBL14067291

SCHEMBL14067291

CNc1nc(N2CCCC2)ncc1C(=O)N1CCOCC1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CAMK1D Q8IU85 4/20 0.47
▸ POLB P06746 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ PTPN11 Q06124 1/20 0.46
▸ LRRK2 Q5S007 5/20 0.45
▸ GBA1 P04062 1/20 0.45
▸ JAK2 O60674 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ CNR2 P34972 1/20 0.43

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
SCHEMBL14625957 0.84 PTPN11 (0.57) POLBSMN1; SMN2PTPN11GBA1ALDH1A1
SCHEMBL14590423 0.79 PTPN11 (0.46) POLBPTPN11JAK2ALDH1A1MAPK1
SCHEMBL14067297 0.79 LRRK2 (0.48) LRRK2JAK2ALDH1A1CNR2
SCHEMBL14590424 0.79 CNR2 (0.46) LRRK2JAK2CNR2
SCHEMBL30751529 0.78 SYK (0.56) CAMK1DLRRK2JAK2
SCHEMBL14590419 0.76 MAPT (0.59) POLBSMN1; SMN2HTTALDH1A1MAPK1
SCHEMBL14590427 0.76 ALDH1A1 (0.53) SMN1; SMN2LRRK2JAK2ALDH1A1KDM4E
Formic Acid SCHEMBL30422549 0.75 PDE4B (0.50) CAMK1DPOLBSMN1; SMN2PTPN11
SCHEMBL14590422 0.74 MAPT (0.63) POLBSMN1; SMN2HTTALDH1A1MAPK1
SCHEMBL10328117 0.74 PIK3CA (0.51) PTPN11

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-1325910-B1 ALIPHATIC NITROGENOUS FIVE-MEMBERED RING COMPOUNDS MITSUBISHI TANABE PHARMA CORP (JP) 2008-09-17 — — EP disclosed
US-7160877-B2 Aliphatic nitrogen-containing 5-membered ring compound TANABE SEIYAKU CO., LTD. (JP) 2007-01-09 — — US disclosed
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