SCHEMBL3129586

SCHEMBL3129586

O=C(O)c1ccc(N(Cc2cncnc2)c2ccc(OC(F)F)c(OC(F)F)c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 6/20 0.45
PDE4B Q07343 5/20 0.45
PDE4C Q08493 4/20 0.45
PDE4D Q08499 4/20 0.45
RXRA P19793 11/20 0.42
RXRB P28702 2/20 0.42
RXRG P48443 2/20 0.42
F11 P03951 1/20 0.37
PPARG P37231 1/20 0.35

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
SCHEMBL3131213 0.95 RXRA (0.50) PDE4APDE4BPDE4CPDE4DRXRA
SCHEMBL3133721 0.94 RXRA (0.41) PDE4APDE4BPDE4CPDE4DRXRA
SCHEMBL3123416 0.92 RXRA (0.44) PDE4APDE4BPDE4CPDE4DRXRA
SCHEMBL3130976 0.91 PDE4D (0.44) PDE4APDE4BPDE4CPDE4DRXRA
SCHEMBL3129460 0.90 PDE4A (0.42) PDE4APDE4BPDE4CPDE4DRXRA
SCHEMBL3133720 0.90 PDE4A (0.41) PDE4APDE4BPDE4CPDE4DRXRA
SCHEMBL3132303 0.90 RXRA (0.47) PDE4APDE4BPDE4CPDE4DRXRA
SCHEMBL3126695 0.89 PDE4A (0.47) PDE4APDE4BPDE4CPDE4D
SCHEMBL3121025 0.88 PDE4B (0.50) PDE4APDE4BPDE4CPDE4DRXRA
SCHEMBL3131461 0.88 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DRXRA

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-02-04 US claimed
WO-2010003084-A2 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-01-07 WO claimed
US-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-02-04 US disclosed
US-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-02-04 US disclosed
US-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-02-04 US disclosed
WO-2010003084-A2 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-01-07 WO disclosed
WO-2010003084-A2 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-01-07 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS PDE4A, PDE4B, PDE3B PDE4A 1/4885PDE4B 2/4885PDE4C 7/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.