SCHEMBL1778588

SCHEMBL1778588

CCOC(=O)c1cc(CC2CCOCC2)n(CCO)n1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 7/20 0.44
FAAH O00519 3/20 0.37
PIK3CA P42336 1/20 0.35
KMT2A Q03164 1/20 0.35
DGAT1 O75907 1/20 0.35
SOAT1 P35610 1/20 0.35
OPRK1 P41145 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
SCHEMBL1777746 0.92 PDE4B (0.43) PDE4BFAAHPIK3CAKMT2AOPRK1
SCHEMBL1776723 0.89 FAAH (0.36) PDE4BFAAHPIK3CAKMT2ADGAT1
SCHEMBL1776895 0.78 P2RY14 (0.35) PDE4B
SCHEMBL1777061 0.77 OPRM1 (0.36) PDE4B
SCHEMBL1778325 0.75 HCAR3 (0.38) PIK3CA
SCHEMBL1233818 0.75 CNR1 (0.42) KMT2A
SCHEMBL19615958 0.74 POLB (0.46) PIK3CAKMT2A
SCHEMBL1777976 0.74 OPRM1 (0.39) PIK3CA
SCHEMBL1233462 0.74 CYP1A2 (0.44) FAAHKMT2A
SCHEMBL1957842 0.73 KMT2A (0.40) PDE4BFAAHPIK3CAKMT2AOPRK1

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-7943636-B2 1-substituted pyrazolo (3,4-C) ring compounds as modulators of cytokine biosynthesis for the treatment of viral infections and neoplastic diseases 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-05-17 US disclosed
US-20090163533-A1 1-Substituted Pyrazolo (3,4-C) Ring Compounds as Modulators of Cytokine Biosynthesis for the Treatment of Viral Infections and Neoplastic Diseases COLEY PHARMACEUTICAL GROUP, INC. (US) 2009-06-25 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-20090163533-A1 1-Substituted Pyrazolo (3,4-C) Ring Compounds as Modulators of Cytokine Biosynthesis for the Treatment of Viral Infections and Neoplastic Diseases IL2, IL4, IFNG PDE4B 941/4885FAAH 4315/4885PIK3CA 1545/4885

“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.