SCHEMBL8325936

SCHEMBL8325936

N=C1CCCCN1Cc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.62
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
SIGMAR1 Q99720 2/20 0.45
SLC2A1 P11166 1/20 0.45
DDB1 Q16531 1/20 0.45
CRBN Q96SW2 1/20 0.45
ACHE P22303 1/20 0.44
LMNA P02545 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
TSHR P16473 2/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.42
POLB P06746 1/20 0.42
HRH3 Q9Y5N1 2/20 0.41
GAA P10253 1/20 0.41
HDAC1 Q13547 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40

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
SCHEMBL11744917 0.94 L3MBTL1 (0.54) L3MBTL1MEN1KMT2ASIGMAR1SLC2A1
SCHEMBL8321647 0.93 L3MBTL1 (0.55) L3MBTL1MEN1KMT2ASIGMAR1SLC2A1
SCHEMBL9057147 0.91 L3MBTL1 (0.53) L3MBTL1MEN1KMT2ASIGMAR1SLC2A1
SCHEMBL11495520 0.88 L3MBTL1 (0.49) L3MBTL1MEN1KMT2ASIGMAR1SLC2A1
SCHEMBL8328135 0.80 GAA (0.52) SIGMAR1LMNASMN1; SMN2HRH3GAA
SCHEMBL11490206 0.79 L3MBTL1 (0.64) L3MBTL1MEN1KMT2ASIGMAR1DDB1
SCHEMBL8551121 0.78 LTA4H (0.54) L3MBTL1SIGMAR1SMN1; SMN2POLBHRH3
SCHEMBL596252 0.78 L3MBTL1 (0.96) L3MBTL1MEN1KMT2ADDB1CRBN
SCHEMBL7497453 0.77 CHRNA7 (0.59) MEN1KMT2ASMN1; SMN2
SCHEMBL9212361 0.76 L3MBTL1 (1.00) L3MBTL1MEN1KMT2ADDB1CRBN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0789571-A4 CYCLIC AMIDINE ANALOGS AS INHIBITORS OF NITRIC OXIDE SYNTHASE MERCK & CO INC (US) 1999-04-14 EP disclosed
EP-0789571-A1 CYCLIC AMIDINE ANALOGS AS INHIBITORS OF NITRIC OXIDE SYNTHASE Merck & Co., Inc. (US) 1997-08-20 EP disclosed
WO-1996014844-A1 CYCLIC AMIDINE ANALOGS AS INHIBITORS OF NITRIC OXIDE SYNTHASE MERCK & CO., INC. (US) 1996-05-23 WO disclosed