SCHEMBL9735594

SCHEMBL9735594

O=C1CCC(C(=O)N2CCN(C(=O)/C=C/c3ccccc3)CC2)N1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
POLB P06746 1/20 0.54
RAB9A P51151 4/20 0.51
LMNA P02545 1/20 0.51
GAA P10253 1/20 0.51
SMN1; SMN2 Q16637 4/20 0.50
NPC1 O15118 4/20 0.50
ME2 P23368 1/20 0.49
ME1 P48163 1/20 0.49
ME3 Q16798 1/20 0.49
MAPT P10636 1/20 0.49
HPGD P15428 1/20 0.49
AR P10275 1/20 0.48
NAMPT P43490 2/20 0.47
GPR183 P32249 2/20 0.47

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
SCHEMBL9735590 1.00 MEN1 (0.57) MEN1KMT2APOLBRAB9ALMNA
SCHEMBL9735480 0.88 MAPT (0.59) POLBRAB9ALMNAGAASMN1; SMN2
SCHEMBL9735488 0.88 MAPT (0.59) POLBRAB9ALMNAGAASMN1; SMN2
SCHEMBL9735198 0.85 GPR183 (0.58) RAB9AGAASMN1; SMN2NPC1MAPT
SCHEMBL9735192 0.85 GPR183 (0.58) RAB9AGAASMN1; SMN2NPC1MAPT
SCHEMBL16599448 0.78 KMT2A (0.89) MEN1KMT2APOLBRAB9ALMNA
SCHEMBL9734952 0.78 NAMPT (0.52) MEN1KMT2APOLBSMN1; SMN2HPGD
SCHEMBL4456981 0.78 KMT2A (0.89) MEN1KMT2APOLBRAB9ALMNA
SCHEMBL16599447 0.78 KMT2A (0.89) MEN1KMT2APOLBRAB9ALMNA
SCHEMBL7950882 0.78 NAMPT (0.51) MEN1KMT2APOLBSMN1; SMN2NAMPT

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
US-5102882-A Nootropic agents NIPPON SHINYAKU CO., LTD. (JP) 1992-04-07 US disclosed