SCHEMBL7181582

SCHEMBL7181582

C=CC(=O)Oc1ccc(N=Nc2ccccc2)c2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.45
▸ KMT2A Q03164 5/20 0.45
▸ L3MBTL1 Q9Y468 5/20 0.45
▸ MAPT P10636 3/20 0.45
▸ NPC1 O15118 3/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ TYMS P04818 1/20 0.43
▸ GLO1 Q04760 3/20 0.39
▸ ESR1 P03372 1/20 0.37
▸ ESR2 Q92731 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ THRB P10828 2/20 0.36
▸ THRA P10827 1/20 0.36
▸ TRPA1 O75762 1/20 0.36
▸ SENP7 Q9BQF6 4/20 0.35
▸ SENP2 Q9HC62 3/20 0.35

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
SCHEMBL7181577 1.00 MEN1 (0.45) MEN1KMT2AL3MBTL1MAPTNPC1
SCHEMBL4328150 0.82 THRB (0.43) MEN1KMT2AL3MBTL1MAPTNPC1
SCHEMBL4328153 0.82 THRB (0.43) MEN1KMT2AL3MBTL1MAPTNPC1
SCHEMBL10720203 0.82 TYMS (0.56) MEN1KMT2AL3MBTL1MAPTNPC1
SCHEMBL373836 0.81 MAPT (0.45) MEN1KMT2AL3MBTL1MAPTNPC1
SCHEMBL1802827 0.81 MAPT (0.45) MEN1KMT2AL3MBTL1MAPTNPC1
SCHEMBL14130394 0.80 MAPT (0.50) MEN1KMT2AL3MBTL1MAPTNPC1
SCHEMBL21657884 0.79 IDE (0.42) MEN1KMT2AL3MBTL1MAPTNPC1
SCHEMBL14130172 0.79 KMT2A (0.46) MEN1KMT2AL3MBTL1MAPTNPC1
SCHEMBL14130409 0.77 KMT2A (0.50) MEN1KMT2AL3MBTL1MAPTNPC1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0722110-B1 Water absorptive soft contact lens MENICON CO LTD (JP) 2003-09-17 — — EP disclosed
US-5661194-A POLYMER FROM MONOMERS OF (METH)ACRYLAMIDE TYPE MONOMER, FLUOROALKYL (SILICON-CONTAINING ALKYL) FUMARATE MONOMER, AND CROSSLINKING MONOMER MENICON CO., LTD. (JP) 1997-08-26 — — US disclosed
EP-0722110-A2 Water absorptive soft contact lens Menicon Co., Ltd. (JP) 1996-07-17 — — EP disclosed
Send feedback