SCHEMBL12994693

SCHEMBL12994693

C=C1C=C(C)c2ccc(N(CC)CC)cc2O1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100B P04271 1/20 0.39
ALDH1A1 P00352 10/20 0.39
L3MBTL1 Q9Y468 5/20 0.39
HSD17B10 Q99714 3/20 0.39
MAPK1 P28482 3/20 0.39
MEN1 O00255 2/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
HPGD P15428 2/20 0.39
KDM4E B2RXH2 3/20 0.37
HTT P42858 2/20 0.37
CASP1 P29466 2/20 0.37
CASP7 P55210 2/20 0.37
RECQL P46063 2/20 0.37
TP53 P04637 1/20 0.37
ALOX15 P16050 1/20 0.37
MPI P34949 1/20 0.37
BRCA1 P38398 1/20 0.37
TERT O14746 1/20 0.37
CYP19A1 P11511 1/20 0.36

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
SCHEMBL22520119 0.87 IGLV6-57 (0.37) MAOBIGLV6-57
SCHEMBL11384630 0.83 ALDH1A1 (0.34) ALDH1A1HSD17B10MAPTHPGDALOX15
SCHEMBL24860265 0.81 S100B (0.36) S100BALDH1A1L3MBTL1HSD17B10MAPK1
SCHEMBL24710860 0.79 ALDH1A1 (0.44) S100BALDH1A1L3MBTL1HSD17B10MAPK1
SCHEMBL29919343 0.79 ALDH1A1 (0.44) S100BALDH1A1L3MBTL1HSD17B10MAPK1
SCHEMBL12205733 0.75 MEN1 (0.36) S100BALDH1A1L3MBTL1HSD17B10MAPK1
SCHEMBL23915960 0.74 CA12 (0.38) ALDH1A1L3MBTL1HSD17B10MAPK1MEN1
SCHEMBL23957861 0.73 MEN1 (0.36) S100BALDH1A1L3MBTL1HSD17B10MAPK1
SCHEMBL7802423 0.73 MAOB (0.49) S100BALDH1A1L3MBTL1HSD17B10MAPK1
SCHEMBL7801117 0.73 MAOB (0.49) S100BALDH1A1L3MBTL1HSD17B10MAPK1

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
US-8293695-B2 Shading composition BASF SE (DE) 2012-10-23 US disclosed
US-20100299849-A1 SHADING PROCESS HOEHENER ALFRED 2010-12-02 US disclosed
US-7799098-B2 Shading process CIBA SPECIALTY CHEMICALS CORP. (US) 2010-09-21 US disclosed
US-20090105108-A1 Shading Process CIBA CORPORATION 2009-04-23 US disclosed