SCHEMBL9054595

SCHEMBL9054595

CN(C)CCOC(=O)C(CC(C)(C)C)C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 3/20 0.46
CHRM2 P08172 2/20 0.46
CHRM3 P20309 2/20 0.46
CHRM4 P08173 1/20 0.46
CHRM5 P08912 1/20 0.46
CHRNB2 P17787 1/20 0.46
CHRNA4 P43681 1/20 0.46
DNM1 Q05193 1/20 0.38
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
PHLPP2 Q6ZVD8 1/20 0.36
LMNA P02545 2/20 0.35
BCHE P06276 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ALDH1A1 P00352 3/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 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
SCHEMBL18773697 0.90 GAA (0.39) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL19273357 0.81
SCHEMBL13875466 0.81 CHRM1 (0.44) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL19101661 0.80 CHRM1 (0.47) CHRM1CHRM2CHRM3CHRM4CHRM5
SCHEMBL24056618 0.79 ALDH1A1 (0.33) ALDH1A1
SCHEMBL12549371 0.79 HCAR2 (0.34) CHRM1LMNAALDH1A1KDM4E
SCHEMBL9054542 0.79 TSHR (0.33) ALDH1A1
SCHEMBL15468449 0.78 TSHR (0.35) CA12CA1CA2CA9
SCHEMBL20925310 0.78
SCHEMBL10066324 0.78 TSHR (0.35) CA12CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11860540-B2 Positive resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2024-01-02 US disclosed
US-20210364921-A1 POSITIVE RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-11-25 US disclosed
US-20210356879-A1 PLANOGRAPHIC PRINTING PLATE PRECURSOR, METHOD OF PREPARING PLANOGRAPHIC PRINTING PLATE, AND PLANOGRAPHIC PRINTING METHOD FUJIFILM CORPORATION (JP) 2021-11-18 US disclosed
EP-3473678-A1 RESIN COMPOSITION AND USE THEREOF Sumitomo Chemical Company Limited (JP) 2019-04-24 EP disclosed
US-8188204-B2 Polymers, compositions and methods for use for foams, laundry detergents, shower rinses and coagulants RHODIA INC. (US) 2012-05-29 US disclosed
US-20110257015-A1 POLYMERS, COMPOSITIONS AND METHODS FOR USE FOR FOAMS, LAUNDRY DETERGENTS, SHOWER RINSES AND COAGULANTS RHODIA INC. (US) 2011-10-20 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-20110257015-A1 POLYMERS, COMPOSITIONS AND METHODS FOR USE FOR FOAMS, LAUNDRY DETERGENTS, SHOWER RINSES AND COAGULANTS DSG1, DSTN, TES CHRM1 3996/4885CHRM2 3383/4885CHRM3 3408/4885

“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.