SCHEMBL11199863

SCHEMBL11199863

c1ccc(Nc2ccc(Nc3ccc(C4CCCCC4)cc3)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 1/20 0.60
ALDH1A1 P00352 5/20 0.52
TDP1 Q9NUW8 3/20 0.52
HSD17B10 Q99714 3/20 0.52
ALOX12 P18054 3/20 0.52
L3MBTL1 Q9Y468 3/20 0.52
MAPK1 P28482 2/20 0.52
ALOX15 P16050 2/20 0.52
TSHR P16473 2/20 0.52
PTGS1 P23219 1/20 0.52
SLC6A2 P23975 1/20 0.52
PTGS2 P35354 1/20 0.52
HTR2B P41595 1/20 0.52
MAPT P10636 6/20 0.50
GAA P10253 4/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
LMNA P02545 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
PDE5A O76074 1/20 0.47

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
SCHEMBL1335958 1.00 NPY5R (0.60) NPY5RALDH1A1TDP1HSD17B10ALOX12
SCHEMBL28690383 0.98 NPY5R (0.57) NPY5RALDH1A1TDP1HSD17B10ALOX12
SCHEMBL31347788 0.94 NPY5R (0.56) NPY5RALDH1A1TDP1HSD17B10ALOX12
SCHEMBL11201092 0.92 MAPT (0.50) NPY5RALDH1A1TDP1MAPTGAA
SCHEMBL3300753 0.92 MAPT (0.50) NPY5RALDH1A1TDP1MAPTGAA
SCHEMBL25906728 0.91 NPY5R (0.52) NPY5RALDH1A1TDP1HSD17B10ALOX12
SCHEMBL27199114 0.91 NPY5R (0.52) NPY5RALDH1A1TDP1HSD17B10ALOX12
SCHEMBL27199120 0.91 NPY5R (0.52) NPY5RALDH1A1TDP1HSD17B10ALOX12
SCHEMBL27199121 0.91 NPY5R (0.52) NPY5RALDH1A1TDP1HSD17B10ALOX12
SCHEMBL10228132 0.90 ALDH1A1 (0.59) NPY5RALDH1A1TDP1HSD17B10ALOX12

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-0072575-A1 N,N'-diphenyl-p-phenylene diamines, method for their production and their use as stabilisers for organic materials Chemische Werke Lowi GmbH (DE) 1983-02-23 EP disclosed