SCHEMBL8903152

SCHEMBL8903152

CCCN(C(=O)Cl)C1CCCCCC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 3/20 0.47
ADH1C P00326 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD11B1 P28845 1/20 0.38
PYGL P06737 1/20 0.38
TSHR P16473 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL8041770 1.00 ADH1A (0.47) ADH1AADH1CL3MBTL1MEN1KMT2A
SCHEMBL8034863 0.98 ADH1A (0.46) ADH1AADH1CL3MBTL1MEN1KMT2A
SCHEMBL7786917 0.90 SLC6A4 (0.36) ADH1AADH1CL3MBTL1PYGLTSHR
SCHEMBL8904583 0.84 L3MBTL1 (0.49) ADH1AADH1CL3MBTL1MEN1KMT2A
SCHEMBL6565132 0.84 L3MBTL1 (0.49) ADH1AADH1CL3MBTL1MEN1KMT2A
SCHEMBL8903632 0.84 L3MBTL1 (0.49) ADH1AADH1CL3MBTL1MEN1KMT2A
SCHEMBL8977205 0.84 CA12 (0.37) ADH1AADH1CMEN1KMT2APYGL
SCHEMBL8977190 0.83 SLC6A4 (0.33) ADH1AADH1CPYGLALDH1A1
SCHEMBL4281691 0.82 ADH1A (0.48) ADH1AADH1CL3MBTL1MEN1KMT2A
SCHEMBL9837028 0.82 ADH1A (0.48) ADH1AADH1CL3MBTL1MEN1KMT2A

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-5652198-A Herbicidally active tetrazolinones NIHON BAYER AGROCHEM K.K. (JP) 1997-07-29 US disclosed
EP-0732326-A1 Herbicidally active tetrazolinones NIHON BAYER AGROCHEM K.K. (JP) 1996-09-18 EP disclosed