SCHEMBL28316059

SCHEMBL28316059

O=C(O)c1cnn(CI)c1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.62
ALKBH2 Q6NS38 2/20 0.46
HPGDS O60760 1/20 0.46
HSD17B10 Q99714 1/20 0.44
EGLN1 Q9GZT9 6/20 0.40
ACHE P22303 2/20 0.40
POLB P06746 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PLA2G4A P47712 1/20 0.39
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
ALKBH1 Q13686 4/20 0.38

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
SCHEMBL31681673 0.83 L3MBTL1 (0.67) L3MBTL1ALKBH2HPGDSHSD17B10EGLN1
SCHEMBL16597309 0.82 L3MBTL1 (0.43) L3MBTL1ACHE
SCHEMBL29954606 0.82 L3MBTL1 (0.65) L3MBTL1ALKBH2HPGDSHSD17B10EGLN1
SCHEMBL28578166 0.80 L3MBTL1 (0.62) L3MBTL1ALKBH2HPGDSHSD17B10EGLN1
SCHEMBL4022892 0.80 L3MBTL1 (0.62) L3MBTL1ALKBH2HPGDSHSD17B10EGLN1
SCHEMBL553834 0.80 L3MBTL1 (0.73) L3MBTL1ALKBH2HPGDSHSD17B10EGLN1
SCHEMBL4900355 0.80 L3MBTL1 (0.62) L3MBTL1ALKBH2HPGDSHSD17B10EGLN1
SCHEMBL18038382 0.78 L3MBTL1 (0.71) L3MBTL1ALKBH2HPGDSHSD17B10EGLN1
Hydrochloric Acid SCHEMBL4758885 0.78 L3MBTL1 (0.71) L3MBTL1ALKBH2HPGDSHSD17B10EGLN1
SCHEMBL31286462 0.77 L3MBTL1 (0.69) L3MBTL1ALKBH2HPGDSHSD17B10EGLN1

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
CN-110072863-A RIP1 kinase inhibitors and methods of use 豪夫迈·罗氏有限公司 2019-07-30 CN disclosed