SCHEMBL28846249

SCHEMBL28846249

CC(=O)C(SC#N)SC#N

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL2845662 0.76
SCHEMBL18069668 0.74
SCHEMBL9218772 0.70 ALDH1A1 (0.31) ALDH1A1MAPT
Acetone SCHEMBL28796157 0.67 LMNA (0.40)
SCHEMBL8759001 0.65
Acetic Acid SCHEMBL1278465 0.63 FFAR3 (0.50)
Acetone SCHEMBL28074260 0.61
SCHEMBL8034630 0.61
Acetic Acid SCHEMBL7858832 0.61 FFAR3 (0.47)
SCHEMBL11416967 0.61

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-106905209-B A kind of synthesis technology of cartap intermediate 宁波科诺华化工有限公司 2018-10-30 CN disclosed
CN-106905209-A A kind of synthesis technique of cartap intermediate 宁波科诺华化工有限公司 2017-06-30 CN disclosed