SCHEMBL27906970

SCHEMBL27906970

CN(C)CC(CC#N)CC#N

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31

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
SCHEMBL4846222 0.85
SCHEMBL27906969 0.76
Bromide SCHEMBL29035845 0.72 TSHR (0.31) CYP1A2MAPK1
SCHEMBL2496509 0.72 CYP1A2 (0.30) CYP1A2MAPK1
SCHEMBL12299444 0.71 ALDH1A1 (0.36)
SCHEMBL9743519 0.71 HTR2A (0.36)
SCHEMBL12445958 0.69
SCHEMBL10416450 0.67
SCHEMBL532188 0.67
SCHEMBL15050246 0.65 TSHR (0.38) CYP1A2MAPK1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103124716-B DMAPN with low DGN content and method for producing DMAPA from DMAPN with low DGN content BASF SE 2014-11-05 CN claimed
CN-103124716-A DMAPN with low DGN content and method for producing DMAPA from DMAPN with low DGN content BASF SE 2013-05-29 CN claimed
CN-103124716-B DMAPN with low DGN content and method for producing DMAPA from DMAPN with low DGN content BASF SE 2014-11-05 CN disclosed
CN-103124716-A DMAPN with low DGN content and method for producing DMAPA from DMAPN with low DGN content BASF SE 2013-05-29 CN disclosed