SCHEMBL6370598

SCHEMBL6370598

CC(C)(C)c1noc(C2(O)CC2)n1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 2/20 0.33
CNR2 P34972 3/20 0.32
MGLL Q99685 1/20 0.31
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL13230295 0.77 PIK3CG (0.36) PIK3CG
Hydrochloric Acid SCHEMBL2392011 0.76 PIK3CG (0.35) PIK3CG
SCHEMBL12310289 0.74 PIK3CG (0.31) PIK3CG
SCHEMBL14942714 0.74 CHRM2 (0.39) CNR2LMNAGAASMN1; SMN2
SCHEMBL22347673 0.73 NR1H4 (0.41)
SCHEMBL29784248 0.72 HTT (0.41) PIK3CGMGLLSMN1; SMN2
SCHEMBL22348525 0.71 NR1H4 (0.42)
SCHEMBL22348690 0.70 NR1H4 (0.35)
SCHEMBL12259390 0.70 FABP4 (0.31)
SCHEMBL12835653 0.69 CNR2 (0.32) CNR2

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-9029377-B2 Platelet-activating factor receptor antagonists MERCK SHARP & DOHME CORP. (US) 2015-05-12 US disclosed
US-8440672-B2 Diphenyl substituted alkanes MERCK SHARP & DOHME CORP. (US) 2013-05-14 US disclosed
US-20120108595-A1 PLATELET-ACTIVATING FACTOR RECEPTOR ANTAGONISTS MERCK SHARP & DOHME LLC 2012-05-03 US disclosed
US-20100168076-A1 DIPHENYL SUBSTITUTED ALKANES MERCK SHARP & DOHME CORP. 2010-07-01 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 (2 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-20120108595-A1 PLATELET-ACTIVATING FACTOR RECEPTOR ANTAGONISTS PTAFR, PAFAH1B2, PAFAH1B3 PIK3CG 1193/4885CNR2 91/4885MGLL 451/4885
US-20100168076-A1 DIPHENYL SUBSTITUTED ALKANES ALOX5, ALOX15, ALOX15B PIK3CG 3531/4885CNR2 826/4885MGLL 283/4885

“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.