SCHEMBL17121271

SCHEMBL17121271

CC(C)(/C=C/CNCc1cccc2ccccc12)CN=[N+]=[N-]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MC5R P33032 2/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ MC1R Q01726 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ SMPD1 P17405 1/20 0.34
▸ CA2 P00918 2/20 0.34
▸ MAPT P10636 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ DNM1 Q05193 1/20 0.33
▸ FOLH1 Q04609 1/20 0.33
▸ CA12 O43570 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA4 P22748 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ ADRA2A P08913 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ SLC6A2 P23975 1/20 0.32

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
SCHEMBL17227620 0.81 LMNA (0.43) MC5RMAPK1KMT2AMEN1MC1R
SCHEMBL20921281 0.72 MC5R (0.50) MC5RMAPK1KMT2AMEN1MC1R
SCHEMBL7523920 0.71 MC5R (0.51) MC5RMAPK1KMT2AMEN1MC1R
SCHEMBL30960251 0.69 LMNA (0.60) MC5RMAPK1KMT2AMEN1MC1R
SCHEMBL30960258 0.69 LMNA (0.60) MC5RMAPK1KMT2AMEN1MC1R
SCHEMBL3256682 0.69 LMNA (0.60) MC5RMAPK1KMT2AMEN1MC1R
SCHEMBL3256688 0.69 LMNA (0.60) MC5RMAPK1KMT2AMEN1MC1R
SCHEMBL8590547 0.69 MC5R (0.53) MC5RMAPK1KMT2AMEN1MC1R
SCHEMBL18087755 0.69 MC5R (0.43) MC5RMAPK1KMT2AMEN1MC1R
Hydrochloric Acid SCHEMBL5928598 0.68 MC5R (0.51) MC5RMAPK1KMT2AMEN1MC1R

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
WO-2015139782-A1 COATED TITANIUM DIOXIDE TO REDUCE THE WHITENING EFFECT ON SKIN SYMRISE AG (DE) 2015-09-24 — — WO disclosed
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