SCHEMBL11080932

SCHEMBL11080932

O=C(c1ccccc1)N1CCN(c2cnccn2)CC1

nearest known ligand 0.85

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A7 Q99884 3/20 0.85
NAMPT P43490 3/20 0.66
ALDH1A1 P00352 3/20 0.61
MAPK1 P28482 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
CKS1B P61024 1/20 0.59
SKP1 P63208 1/20 0.59
SKP2 Q13309 1/20 0.59
KDM4E B2RXH2 2/20 0.58
PKM P14618 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55

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
SCHEMBL3575539 0.92 SLC6A7 (1.00) SLC6A7NAMPTALDH1A1MAPK1L3MBTL1
SCHEMBL11078057 0.90 SLC6A7 (0.70) SLC6A7NAMPTALDH1A1MAPK1KDM4E
SCHEMBL94351 0.86 SLC6A7 (0.73) SLC6A7NAMPTALDH1A1MAPK1L3MBTL1
SCHEMBL27872912 0.86 SLC6A7 (0.69) SLC6A7NAMPTALDH1A1MAPK1L3MBTL1
SCHEMBL12082792 0.86 SLC6A7 (0.73) SLC6A7NAMPTKDM4EPKMSMN1; SMN2
SCHEMBL19562177 0.86 SLC6A7 (0.73) SLC6A7NAMPTALDH1A1MAPK1L3MBTL1
SCHEMBL4417155 0.86 SLC6A7 (0.65) SLC6A7NAMPTALDH1A1MEN1KMT2A
SCHEMBL4415437 0.82 SLC6A7 (0.64) SLC6A7NAMPTMAPK1
SCHEMBL3710705 0.82 SLC6A7 (0.62) SLC6A7NAMPTL3MBTL1KDM4EMEN1
SCHEMBL4319854 0.81 SLC6A7 (0.62) SLC6A7NAMPTMAPK1

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-4439606-A ANTICHOLESTEROL, ANTILIPEMIC AGENTS AMERICAN CYANAMID COMPANY (US) 1984-03-27 US claimed