SCHEMBL17418205

SCHEMBL17418205

COCCOCCOCCOCCC(=O)[O-].C[n+]1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
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
SCHEMBL17418379 1.00 TSHR (0.32) TSHRUSP2ALDH1A1SMN1; SMN2
SCHEMBL17418177 1.00 TSHR (0.32) TSHRUSP2ALDH1A1SMN1; SMN2
SCHEMBL17418212 0.87 ALDH1A1 (0.36) TSHRUSP2ALDH1A1SMN1; SMN2
SCHEMBL17418518 0.86 ACHE (0.34) ALDH1A1
SCHEMBL17418838 0.86 FFAR3 (0.31)
SCHEMBL17418851 0.86 ACHE (0.34) ALDH1A1
SCHEMBL17418229 0.86 FFAR3 (0.31)
SCHEMBL17418317 0.86 FFAR3 (0.31)
SCHEMBL17418352 0.86 ACHE (0.34) ALDH1A1
SCHEMBL17418913 0.83 CHRM2 (0.34) TSHRSMN1; SMN2

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-10087155-B2 Onium salt, liquid composition containing said onium salt and cellulose, and cellulose recovery method KOEI CHEMICAL COMPANY, LIMITED (JP) 2018-10-02 US disclosed
US-20160009669-A1 ONIUM SALT, LIQUID COMPOSITION CONTAINING SAID ONIUM SALT AND CELLULOSE, AND CELLULOSE RECOVERY METHOD KOEI CHEMICAL COMPANY, LIMITED (JP) 2016-01-14 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-20160009669-A1 ONIUM SALT, LIQUID COMPOSITION CONTAINING SAID ONIUM SALT AND CELLULOSE, AND CELLULOSE RECOVERY METHOD CEL, CROCC, ALG1 TSHR 4776/4885USP2 1720/4885ALDH1A1 4797/4885
US-10087155-B2 Onium salt, liquid composition containing said onium salt and cellulose, and cellulose recovery method CEL, CROCC, ALG1 TSHR 4776/4885USP2 1720/4885ALDH1A1 4797/4885

“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.