SCHEMBL9301293

SCHEMBL9301293

CNC(C1CCN(C(=O)c2ccc(C)cc2)CC1)C1COc2ccccc2O1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
KMT2A Q03164 4/20 0.44
MEN1 O00255 2/20 0.44
EPHX2 P34913 1/20 0.43
RAB9A P51151 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
MAPT P10636 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
HSD11B1 P28845 1/20 0.40
MGLL Q99685 1/20 0.40
ALDH1A1 P00352 2/20 0.40
UBE2M P61081 1/20 0.39
DCUN1D1 Q96GG9 1/20 0.39

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
SCHEMBL9301405 0.93 ACHE (0.46) LMNAKMT2AEPHX2L3MBTL1SMN1; SMN2
SCHEMBL9302303 0.89 EPHX2 (0.47) LMNAKMT2AMEN1EPHX2RAB9A
SCHEMBL9301807 0.86 TSHR (0.45) KMT2AMEN1HSD11B1ALDH1A1UBE2M
SCHEMBL9301986 0.84 CYP2D6 (0.46) KMT2AMEN1L3MBTL1HSD11B1MGLL
SCHEMBL9302654 0.83 EPHX2 (0.45) LMNAKMT2AMEN1EPHX2L3MBTL1
SCHEMBL9301620 0.82 RBP4 (0.48) LMNAKMT2AMEN1HSD11B1MGLL
SCHEMBL7438480 0.79 LMNA (0.44) LMNAKMT2AMEN1EPHX2RAB9A
SCHEMBL9303117 0.79 LTA4H (0.48) MAPT
SCHEMBL9301418 0.76 ACHE (0.43) LMNAKMT2AMEN1EPHX2L3MBTL1
SCHEMBL9302070 0.75 EPHX2 (0.47) LMNAKMT2AMEN1EPHX2L3MBTL1

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
US-5286735-A Antidepressants, anxiolytic agents PIERRE FABRE MEDICAMENT (FR) 1994-02-15 US claimed
US-5286735-A Antidepressants, anxiolytic agents PIERRE FABRE MEDICAMENT (FR) 1994-02-15 US disclosed