Sugi Predict

Sugi Predict / Compounds / SCHEMBL7855075

SCHEMBL7855075

SCHEMBL7855075

COc1cc2c(cc1OC)N(C)C(=O)/C2=C/c1ccc(OC)c(O[C@H]2C[C@@H]3CC[C@H]2C3)c1

nearest known ligand 0.80

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 15/20 0.80
▸ PDE4A P27815 13/20 0.80
▸ PDE4C Q08493 13/20 0.80
▸ PDE4D Q08499 13/20 0.80
▸ PDE3B Q13370 1/20 0.61
▸ PDE3A Q14432 1/20 0.61
▸ MAPT P10636 1/20 0.40
▸ HTT P42858 1/20 0.40

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
SCHEMBL7850746 1.00 PDE4B (0.80) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7852470 0.90 PDE4B (0.82) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7851247 0.90 PDE4B (0.82) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7852231 0.90 PDE4B (0.82) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7842977 0.90 PDE4B (0.74) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7843470 0.90 PDE4B (0.74) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7843451 0.90 PDE4B (0.79) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7851425 0.90 PDE4B (0.79) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7852973 0.89 PDE4B (1.00) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7851880 0.89 PDE4B (1.00) PDE4BPDE4APDE4CPDE4DPDE3B

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-0730579-B1 SUBSTITUTED INDOLES AS PHOSPHODIESTERASE TYPE IV INHIBITORS PFIZER (US) 2001-03-07 — — EP disclosed