SCHEMBL7423948

SCHEMBL7423948

COc1ccc(C(=O)O)c2cc(C(=O)C3CC3)oc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 15/20 0.48
PDE4B Q07343 12/20 0.48
PDE4A P27815 11/20 0.48
PDE4C Q08493 11/20 0.48
KDM4E B2RXH2 1/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA3 P07451 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40
CA5A P35218 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
CA5B Q9Y2D0 1/20 0.40
LMNA P02545 1/20 0.40
RECQL P46063 1/20 0.40
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL7056726 0.84 PDE4A (0.62) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL7422796 0.83 F2RL3 (0.44) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL7051399 0.81 PDE4A (0.55) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL6839328 0.78 SMN1; SMN2 (0.62) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL7425562 0.78 ALDH1A1 (0.43) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL6839386 0.77 PDE4A (0.48) PDE4DPDE4BPDE4APDE4C
SCHEMBL7053234 0.77 PDE4A (0.50) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL6947312 0.77 PDE4D (0.55) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL7053236 0.77 PDE4A (0.50) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL7053230 0.77 PDE4A (0.50) PDE4DPDE4BPDE4APDE4CKDM4E

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-1054884-A1 BENZOFURAN-4-CARBOXAMIDES AND THEIR THERAPEUTIC USE Darwin Discovery Limited (GB) 2000-11-29 EP disclosed
US-6066657-A Benzofuran-4-carboxamides and their therapeutic use DARWIN DISCOVERY, LTD. (GB) 2000-05-23 US disclosed
WO-1999040085-A1 BENZOFURAN-4-CARBOXAMIDES AND THEIR THERAPEUTIC USE DARWIN DISCOVERY LIMITED (GB) 1999-08-12 WO disclosed