SCHEMBL7056652

SCHEMBL7056652

CCc1ccccc1-c1ccc(OC)c2oc(C(C)=O)c(C(N)=O)c12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 3/20 0.37
IKBKB O14920 1/20 0.37
LMNA P02545 1/20 0.36
RECQL P46063 1/20 0.36
KDM4E B2RXH2 2/20 0.35
POLB P06746 1/20 0.35
CTDSP1 Q9GZU7 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 2/20 0.35
KMT2A Q03164 1/20 0.35
PDE4A P27815 2/20 0.35
PDE4B Q07343 2/20 0.35
PDE4C Q08493 2/20 0.35
PDE4D Q08499 2/20 0.35
MKNK2 Q9HBH9 2/20 0.34
PLA2G2A P14555 2/20 0.34
CA9 Q16790 1/20 0.34
FPR1 P21462 1/20 0.33
GAA P10253 1/20 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
SCHEMBL7052699 0.89 IKBKB (0.45) SLC9A1IKBKBLMNARECQLKDM4E
SCHEMBL7054012 0.86 IKBKB (0.39) SLC9A1IKBKBLMNARECQLKDM4E
SCHEMBL7051176 0.85 PDE4A (0.41) IKBKBLMNARECQLKDM4EPOLB
SCHEMBL7050095 0.83 MKNK2 (0.40) SLC9A1IKBKBLMNARECQLKDM4E
O-Tolylamine SCHEMBL7366469 0.82 IKBKB (0.38) SLC9A1IKBKBLMNARECQLKDM4E
SCHEMBL7052315 0.82 ALDH1A1 (0.48) IKBKBLMNARECQLL3MBTL1ALDH1A1
SCHEMBL7402562 0.81 CYP1A1 (0.39) SLC9A1IKBKBLMNARECQLL3MBTL1
SCHEMBL7056892 0.81 LMNA (0.40) IKBKBLMNARECQLKDM4EPOLB
SCHEMBL7055258 0.80 PDE4A (0.45) IKBKBLMNARECQLKDM4EPOLB
SCHEMBL7394827 0.79 MKNK2 (0.37) SLC9A1IKBKBLMNAKDM4EPOLB

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-0901482-B1 BENZOFURAN CARBOXAMIDES AND THEIR THERAPEUTIC USE DARWIN DISCOVERY LTD (GB) 2003-05-02 EP disclosed
EP-0901482-A1 BENZOFURAN CARBOXAMIDES AND THEIR THERAPEUTIC USE Darwin Discovery Limited (GB) 1999-03-17 EP disclosed
WO-1997044337-A1 BENZOFURAN CARBOXAMIDES AND THEIR THERAPEUTIC USE DARWIN DISCOVERY LIMITED (GB) 1997-11-27 WO disclosed