SCHEMBL7681232

SCHEMBL7681232

O=C(Oc1cccc2cccnc12)c1cc2cc(CCl)ccc2oc1=O

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F2 P00734 6/20 0.68
F12 P00748 3/20 0.54
USP2 O75604 1/20 0.52
POLB P06746 2/20 0.51
KDM4E B2RXH2 1/20 0.51
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
L3MBTL1 Q9Y468 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
SCHEMBL7681929 0.88 F2 (0.67) F2F12POLBMEN1KMT2A
SCHEMBL7675556 0.87 F2 (0.65) F2F12POLBMEN1KMT2A
SCHEMBL7679435 0.83 F2 (0.60) F2F12POLBMEN1KMT2A
SCHEMBL7675753 0.83 F2 (0.73) F2F12POLBKDM4E
SCHEMBL7681326 0.82 F2 (0.67) F2F12POLBKDM4E
SCHEMBL7682241 0.81 F2 (0.71) F2F12POLBKDM4EMEN1
SCHEMBL7675981 0.81 F2 (1.00) F2F12MEN1KMT2A
SCHEMBL14642319 0.81 F2 (0.78) F2F12POLBKDM4EMEN1
SCHEMBL7679864 0.80 F2 (1.00) F2F12MEN1KMT2A
SCHEMBL18752290 0.80 F2 (0.73) F2F12POLBMEN1KMT2A

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-6355658-B1 COUMARIN ESTERS WITH ETHER GROUPS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2002-03-12 US disclosed