SCHEMBL10697753

SCHEMBL10697753

CC(C(=O)O)(c1ccccn1)C1CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
CHRM3 P20309 1/20 0.39
RIPK1 Q13546 1/20 0.39
BLM P54132 2/20 0.39
CYP2D6 P10635 1/20 0.39
GRM1 Q13255 1/20 0.38
LMNA P02545 1/20 0.38
NAPRT Q6XQN6 1/20 0.38
P4HTM Q9NXG6 1/20 0.38
GLA P06280 1/20 0.38
ALDH1A1 P00352 1/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KDM4E B2RXH2 2/20 0.36
CYP19A1 P11511 1/20 0.36
SLC22A2 O15244 1/20 0.36
SLC22A1 O15245 1/20 0.36

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
SCHEMBL10696448 0.94 KEAP1 (0.44) L3MBTL1SMN1; SMN2CHRM3KEAP1NFE2L2
SCHEMBL10697581 0.92 KEAP1 (0.43) L3MBTL1SMN1; SMN2CHRM3LMNAKEAP1
SCHEMBL6924068 0.79 KEAP1 (0.51) L3MBTL1SMN1; SMN2CHRM3LMNANAPRT
SCHEMBL17490358 0.76 SMN1; SMN2 (0.53) L3MBTL1SMN1; SMN2CHRM3RIPK1BLM
SCHEMBL8972314 0.76 SMN1; SMN2 (0.44) L3MBTL1SMN1; SMN2CHRM3RIPK1BLM
SCHEMBL5074249 0.75 L3MBTL1 (0.52) L3MBTL1SMN1; SMN2BLMCYP2D6LMNA
SCHEMBL505194 0.75 L3MBTL1 (0.52) L3MBTL1SMN1; SMN2BLMCYP2D6LMNA
SCHEMBL4243455 0.75 KEAP1 (0.50) CHRM3GLAKEAP1NFE2L2
SCHEMBL4243228 0.75 KEAP1 (0.50) CHRM3GLAKEAP1NFE2L2
SCHEMBL27749385 0.75 KEAP1 (0.50) CHRM3GLAKEAP1NFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0253681-A2 Cycloalkyl-substituted 4-pyridyl derivatives and process for their preparation FARMITALIA CARLO ERBA S.r.l. (IT) 1988-01-20 EP disclosed