SCHEMBL9999776

SCHEMBL9999776

CCC1C[N+](C)(CC2CO2)CC1CC

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL13770474 0.77 ALDH1A1 (0.33) THRBALDH1A1
SCHEMBL11552985 0.70 CTDSP1 (0.50) THRBALDH1A1
SCHEMBL9118629 0.68 CTDSP1 (0.37) THRBALDH1A1
SCHEMBL19164699 0.68 CTDSP1 (0.44) THRBALDH1A1
SCHEMBL15829649 0.67 GNAI3 (0.32)
SCHEMBL21184287 0.67
SCHEMBL20412236 0.67
SCHEMBL11338454 0.67 THRB (0.53) THRB
Hydrochloric Acid SCHEMBL9635896 0.67 CTDSP1 (0.51) THRB
Hydrochloric Acid SCHEMBL3759338 0.67 CTDSP1 (0.36) THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8466216-B2 Low odor binders curable at room temperature KIMBERLY-CLARK WORLDWIDE, INC. (US) 2013-06-18 US disclosed
US-8453849-B2 Anti-microbial matrix and filtration system 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-06-04 US disclosed
US-8123959-B2 Treatment of solid particles with functional agents 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-02-28 US disclosed
US-20110006009-A1 ANTI-MICROBIAL MATRIX AND FILTRATION SYSTEM 3M INNOVATIVE PROPERTIES COMPANY 2011-01-13 US disclosed
US-7566381-B2 Low odor binders curable at room temperature KIMBERLY-CLARK WORLDWIDE, INC. (US) 2009-07-28 US disclosed
US-20090134099-A1 TREATMENT OF SOLID PARTICLES WITH FUNCTIONAL AGENTS 3M INNOVATIVE PROPERTIES COMPANY 2009-05-28 US disclosed
US-20080093310-A1 ANTI-MICROBIAL MEDIA AND METHODS FOR MAKING AND UTILIZING THE SAME 3M INNOVATIVE PROPERTIES COMPANY 2008-04-24 US disclosed
US-20070187056-A1 Low odor binders curable at room temperature KIMBERLY-CLARK WORLDWIDE, INC. 2007-08-16 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-20090134099-A1 TREATMENT OF SOLID PARTICLES WITH FUNCTIONAL AGENTS CAPG, FBL, MYD88 THRB 4569/4885ALDH1A1 4672/4885

“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.