SCHEMBL11111555

SCHEMBL11111555

N/N=C/c1ccc(Cl)c(Cl)c1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.38
TLR4 O00206 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPK1 P28482 1/20 0.37
NPSR1 Q6W5P4 3/20 0.36
PPP1R15A O75807 1/20 0.36
MELK Q14680 1/20 0.36
PPP1R15B Q5SWA1 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TSHR P16473 2/20 0.34
HPGD P15428 1/20 0.34
CASP1 P29466 1/20 0.34
HSD17B10 Q99714 1/20 0.34
NPFFR2 Q9Y5X5 2/20 0.33
KMT2A Q03164 1/20 0.33
GRIN2D O15399 3/20 0.33
GRIN3B O60391 3/20 0.33
GRIN1 Q05586 3/20 0.33
GRIN2A Q12879 3/20 0.33
GRIN2B Q13224 3/20 0.33

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
SCHEMBL11111572 1.00 MAOB (0.38) MAOBTLR4CYP3A4MAPK1NPSR1
SCHEMBL6668121 0.82 ALOX12 (0.42) TLR4CYP3A4MAPK1NPSR1PPP1R15A
SCHEMBL3697881 0.76 GAA (0.44) MAOBNPSR1PPP1R15AMELKPPP1R15B
SCHEMBL658824 0.72 ERN1 (0.47) CYP3A4MAPK1NPSR1L3MBTL1TSHR
SCHEMBL28420537 0.72 POLB (0.56) TLR4MAPK1L3MBTL1HPGDKMT2A
SCHEMBL2319124 0.72 POLB (0.56) TLR4MAPK1L3MBTL1HPGDKMT2A
SCHEMBL30275282 0.71 L3MBTL1 (0.59) MAOBNPSR1PPP1R15AMELKPPP1R15B
SCHEMBL6847216 0.71 L3MBTL1 (0.59) MAOBNPSR1PPP1R15AMELKPPP1R15B
SCHEMBL2697239 0.68 ERN1 (0.57) CYP3A4NPSR1L3MBTL1TSHRHPGD
SCHEMBL30301104 0.68 MAOB (0.47) MAOBCYP3A4MAPK1NPSR1TSHR

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
US-4474952-A ORGANIC PIGMENTS CIBA-GEIGY CORPORATION (US) 1984-10-02 US disclosed