SCHEMBL4072907

SCHEMBL4072907

CN1CCC(N2CCN(CC=O)CC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.39
L3MBTL3 Q96JM7 1/20 0.39
ALDH1A1 P00352 2/20 0.37
ACHE P22303 2/20 0.33
NCF1 P14598 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
KDM4E B2RXH2 1/20 0.32
RAD52 P43351 1/20 0.32
RECQL P46063 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HTR7 P34969 1/20 0.31
KMT2A Q03164 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
SCHEMBL2555402 0.86 SIGMAR1 (0.36) ALDH1A1SIGMAR1KDM4EKMT2A
SCHEMBL29824951 0.82 SIGMAR1 (0.45) ALDH1A1SIGMAR1KDM4EHTR7KMT2A
SCHEMBL13698377 0.80 PAOX (0.38) ALDH1A1SIGMAR1RAD52KMT2A
SCHEMBL1655253 0.80 PAOX (0.38) ALDH1A1SIGMAR1RAD52KMT2A
SCHEMBL18351064 0.80 PAOX (0.38) ALDH1A1SIGMAR1RAD52KMT2A
SCHEMBL3930612 0.79 L3MBTL3 (0.38) L3MBTL1L3MBTL3ALDH1A1KDM4ERECQL
SCHEMBL3932472 0.79 L3MBTL3 (0.40) L3MBTL1L3MBTL3ALDH1A1KDM4ERECQL
SCHEMBL26042815 0.78 L3MBTL1 (0.40) L3MBTL1L3MBTL3ALDH1A1ACHENCF1
SCHEMBL4067143 0.78 CACNA2D1 (0.43) ACHENCF1SIGMAR1
SCHEMBL3939588 0.77 ALDH1A1 (0.42) L3MBTL1L3MBTL3ALDH1A1KDM4ERECQL

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-2066659-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2009-06-10 EP claimed
WO-2008040492-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2008-04-10 WO claimed