SCHEMBL19225221

SCHEMBL19225221

CN(C)CC/C=N/CCCN(C)C

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
TSHR P16473 1/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2D6 P10635 1/20 0.39
DNM1 Q05193 3/20 0.33
LMNA P02545 1/20 0.31
HRH2 P25021 1/20 0.30
HRH4 Q9H3N8 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
MAP1LC3B Q9GZQ8 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL18397994 0.83 DNM1 (0.48) ALDH1A1TSHRDNM1
SCHEMBL1969872 0.81 CYP1A2 (0.43) ALDH1A1TSHRCYP1A2CYP2D6DNM1
Hydrochloric Acid SCHEMBL30147641 0.79 CYP1A2 (0.42) ALDH1A1TSHRCYP1A2CYP2D6DNM1
SCHEMBL16202247 0.75
SCHEMBL31512115 0.75
SCHEMBL14000488 0.74 CYP1A2 (0.47) ALDH1A1TSHRCYP1A2CYP2D6DNM1
SCHEMBL18909349 0.74
Hydrochloric Acid SCHEMBL28470172 0.73 CYP1A2 (0.36) ALDH1A1TSHRCYP1A2CYP2D6DNM1
SCHEMBL13672811 0.71 ALDH1A1 (0.39) ALDH1A1TSHRCYP1A2CYP2D6DNM1
SCHEMBL7146648 0.71

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
EP-2206746-B1 COMPOSITION CONTAINING POLYSILAZANE COMPOUND, WHICH CAN PROVIDE DENSE SILICEOUS FILM MERCK PATENT GMBH (DE) 2017-08-09 EP disclosed