SCHEMBL918332

SCHEMBL918332

CS(=O)(=O)Nc1ccc(Oc2cc(C3=NOC4(CCOC4)C3)ccc2OC(F)F)cc1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KIT P10721 2/20 0.34
SLC6A4 P31645 6/20 0.33
BRD4 O60885 2/20 0.33
KIF11 P52732 1/20 0.33
PGR P06401 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A3 Q01959 1/20 0.33
IKBKB O14920 1/20 0.31
LTA4H P09960 1/20 0.31
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
ABL1 P00519 1/20 0.31
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
PTGS2 P35354 1/20 0.31

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
SCHEMBL917981 0.87 HPGD (0.37) IKBKBPDE4APDE4BPDE4CPDE4D
SCHEMBL916011 0.86 RAB9A (0.34) PDE4APDE4BPDE4CPDE4D
SCHEMBL916684 0.86 SSTR5 (0.34)
SCHEMBL917073 0.85 GRIN1 (0.30) PDE4A
SCHEMBL916371 0.85 MAP3K12 (0.31)
SCHEMBL915571 0.85 SSTR5 (0.33)
SCHEMBL917867 0.84
SCHEMBL3828712 0.84
SCHEMBL917812 0.84
SCHEMBL917074 0.83 FFAR1 (0.32) SLC6A4MMP1MMP2

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 4 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
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 KIT 415/4885SLC6A4 808/4885BRD4 544/4885

“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.