SCHEMBL28166706

SCHEMBL28166706

C[C](C)CN1CCC(C#N)C1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 1/20 0.35
HRH3 Q9Y5N1 1/20 0.30
LTA4H P09960 1/20 0.30

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
SCHEMBL28159166 0.88 HRH3 (0.36) HRH3LTA4H
SCHEMBL26180864 0.79 HSD17B10 (0.37) L3MBTL3HRH3LTA4H
SCHEMBL12635341 0.78 KDM4E (0.40) L3MBTL3HRH3
SCHEMBL1006688 0.78 KDM4E (0.40) L3MBTL3HRH3
SCHEMBL1010131 0.78 KDM4E (0.40) L3MBTL3HRH3
SCHEMBL24661958 0.78
SCHEMBL9870758 0.78
SCHEMBL26906156 0.78
SCHEMBL24662678 0.78
SCHEMBL12311375 0.78 MCL1 (0.36) L3MBTL3HRH3

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
CN-107474024-A A kind of glutamy enzyme inhibitor and combinations thereof and purposes 北京赛林泰医药技术有限公司 2017-12-15 CN disclosed
CN-107001339-A Novel compounds 特殊治疗有限公司 2017-08-01 CN disclosed