SCHEMBL917232

SCHEMBL917232

O=C(c1ccc(F)cc1)N1CC[C@@H](Oc2cc(C3=NOC4(CCOC4)C3)ccc2OC(F)F)C1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 9/20 0.36
SSTR5 P35346 3/20 0.35
PDE4A P27815 4/20 0.35
PDE4B Q07343 4/20 0.35
PDE4C Q08493 4/20 0.35
HTR2B P41595 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD11B1 P28845 1/20 0.34
GRM5 P41594 1/20 0.34
CLPP Q16740 1/20 0.34
MCHR1 Q99705 1/20 0.34
BCL9 O00512 1/20 0.34
CTNNB1 P35222 1/20 0.34
POLB P06746 1/20 0.33

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
SCHEMBL916770 0.96 GRM5 (0.38) PDE4DSSTR5PDE4APDE4BPDE4C
SCHEMBL917169 0.95 PDE4D (0.38) PDE4DSSTR5PDE4APDE4BPDE4C
SCHEMBL5048063 0.93 PDE4B (0.38) PDE4DPDE4APDE4BPDE4CMEN1
SCHEMBL916480 0.93 PDE4B (0.38) PDE4DPDE4APDE4BPDE4CMEN1
SCHEMBL3680467 0.89 PDE4D (0.37) PDE4DPDE4APDE4BPDE4C
SCHEMBL3676661 0.89 PDE4D (0.37) PDE4DPDE4APDE4BPDE4C
SCHEMBL916979 0.89 PDE4B (0.39) PDE4DPDE4APDE4BPDE4CMEN1
SCHEMBL918227 0.89 MEN1 (0.39) PDE4DPDE4APDE4BPDE4CMEN1
SCHEMBL916681 0.88 PIK3CD (0.39) PDE4DPDE4APDE4BPDE4C
SCHEMBL918060 0.88 PIK3CD (0.40) 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 2 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
US-20110021473-A1 INHIBITORS OF PHOSPHODIESTERASE TYPE-IV RANBAXY LABORATORIES LIMITED 2011-01-27 US 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 PDE4D 6/4885SSTR5 3863/4885PDE4A 1/4885

“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.