SCHEMBL917856

SCHEMBL917856

COc1cc(C2=NOC3(CSC3)C2)ccc1OC(F)F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 8/20 0.43
PDE4A P27815 8/20 0.43
PDE4D Q08499 7/20 0.43
PDE4C Q08493 6/20 0.43
PDE3B Q13370 3/20 0.43
PDE3A Q14432 3/20 0.43
LMNA P02545 2/20 0.43
TP53 P04637 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
CYP2C19 P33261 1/20 0.43
BLM P54132 1/20 0.43
PMP22 Q01453 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GRM2 Q14416 5/20 0.38
MIF P14174 2/20 0.36
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL916383 0.92 PDE4A (0.39) PDE4BPDE4APDE4DPDE4CPDE3B
SCHEMBL916749 0.88 PDE4B (0.43) PDE4BPDE4APDE4DPDE4CPDE3B
SCHEMBL917078 0.88 PDE4B (0.43) PDE4BPDE4APDE4DPDE4CPDE3B
SCHEMBL917128 0.88 PDE4B (0.43) PDE4BPDE4APDE4DPDE4CPDE3B
SCHEMBL916762 0.87 PDE4B (0.42) PDE4BPDE4APDE4DPDE4CPDE3B
SCHEMBL917291 0.86 GRM2 (0.43) PDE4BPDE4APDE4DPDE4CPDE3B
SCHEMBL918081 0.85 PDE4B (0.43) PDE4BPDE4APDE4DPDE4CPDE3B
SCHEMBL917932 0.85 PDE4B (0.46) PDE4BPDE4APDE4DPDE4CPDE3B
SCHEMBL916821 0.85 PDE4B (0.41) PDE4BPDE4APDE4DPDE4CPDE3B
SCHEMBL917209 0.85 PDE4B (0.41) PDE4BPDE4APDE4DPDE4CPDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110021473-A1 INHIBITORS OF PHOSPHODIESTERASE TYPE-IV RANBAXY LABORATORIES LIMITED 2011-01-27 US claimed
EP-2086948-A2 INHIBITORS OF PHOSPHODIESTERASE TYPE-IV Ranbaxy Laboratories Limited (IN) 2009-08-12 EP claimed
WO-2008035315-A2 INHIBITORS OF PHOSPHODIESTERASE TYPE-IV RANBAXY LABORATORIES LIMITED (IN) 2008-03-27 WO claimed
US-20110021473-A1 INHIBITORS OF PHOSPHODIESTERASE TYPE-IV RANBAXY LABORATORIES LIMITED 2011-01-27 US disclosed
EP-2086948-A2 INHIBITORS OF PHOSPHODIESTERASE TYPE-IV Ranbaxy Laboratories Limited (IN) 2009-08-12 EP disclosed
WO-2008035315-A2 INHIBITORS OF PHOSPHODIESTERASE TYPE-IV RANBAXY LABORATORIES LIMITED (IN) 2008-03-27 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-20110021473-A1 INHIBITORS OF PHOSPHODIESTERASE TYPE-IV PDE4A, PDE4B, PDE4C PDE4B 2/4885PDE4A 1/4885PDE4D 6/4885

“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.