SCHEMBL8553907

SCHEMBL8553907

COc1ccc(C(=O)O)cc1OC1CC2CCC1O2

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA4 P22748 1/20 0.52
CA6 P23280 1/20 0.52
CA7 P43166 1/20 0.52
TPMT P51580 1/20 0.52
CA9 Q16790 1/20 0.52
CA14 Q9ULX7 1/20 0.52
PDE4D Q08499 10/20 0.50
PDE4A P27815 9/20 0.50
PDE4B Q07343 9/20 0.50
PDE4C Q08493 9/20 0.50
TSHR P16473 2/20 0.44
HTT P42858 2/20 0.43
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.43
RAB9A P51151 1/20 0.43
TTR P02766 1/20 0.42

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
SCHEMBL7363109 0.90 PDE4D (0.42) CA12CA1CA2CA4CA6
SCHEMBL7354542 0.85 PDE4D (0.44) PDE4DPDE4APDE4BPDE4C
SCHEMBL7358710 0.83 AR (0.36) CA12CA1CA2CA4CA6
SCHEMBL7363194 0.82 MRGPRX4 (0.43) RAB9A
SCHEMBL7357205 0.80 PDE4D (0.66) PDE4DPDE4APDE4BPDE4C
SCHEMBL7362448 0.79 ALDH1A1 (0.51) PDE4DPDE4APDE4BPDE4CTSHR
SCHEMBL7361951 0.79 PDE4D (0.64) PDE4DPDE4APDE4BPDE4C
SCHEMBL7361572 0.79 PDE4D (0.68) PDE4DPDE4APDE4BPDE4C
SCHEMBL8556184 0.78 PDE4B (0.53) CA12CA1CA2CA4CA6
SCHEMBL7357012 0.78 PDE4D (0.44) PDE4DPDE4APDE4BPDE4C

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
EP-0741707-B1 SUBSTITUTED AROMATIC COMPOUNDS AS c.AMP PHOSPHODIESTERASE- AND TNF-INHIBITORS RHONE POULENC RORER LTD (GB) 1998-04-01 EP disclosed