SCHEMBL8944529

SCHEMBL8944529

CCCCCCN(C=O)N1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 2/20 0.43
ADH1C P00326 1/20 0.43
ADH4 P08319 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.35
DNM1 Q05193 3/20 0.34
KDM4E B2RXH2 1/20 0.33
TSHR P16473 1/20 0.33
SIGMAR1 Q99720 1/20 0.32

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
SCHEMBL28684578 1.00 ADH1A (0.43) ADH1AADH1CADH4L3MBTL1MEN1
SCHEMBL28098320 0.91 ADH1C (0.47) ADH1AADH1CADH4DNM1TSHR
SCHEMBL27868845 0.91 ADH1C (0.47) ADH1AADH1CADH4DNM1TSHR
SCHEMBL28228737 0.80 ADH1C (0.32) ADH1AADH1CADH4SMN1; SMN2
SCHEMBL3710483 0.77 ADH1A (0.38) ADH1AADH1CSMN1; SMN2
SCHEMBL26160891 0.75 DNM1 (0.41) ADH1AADH1CADH4L3MBTL1MEN1
SCHEMBL1749630 0.74 ADH1C (0.34) ADH1AADH1CSMN1; SMN2
SCHEMBL3700583 0.73 SMN1; SMN2 (0.39) MEN1KMT2ATDP1SMN1; SMN2KDM4E
SCHEMBL8894973 0.72 DNM1 (0.42) ADH1AADH1CADH4L3MBTL1MEN1
SCHEMBL28915967 0.72 DNM1 (0.42) ADH1AADH1CADH4L3MBTL1MEN1

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-5541229-A ANGIOITENSIN II ANTAGONIST AS HYPOTENSIVE AGENTS, ANTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS DR. KARL THOMAE GMBH (DE) 1996-07-30 US disclosed