SCHEMBL19213283

SCHEMBL19213283

COC1OC(COCCO)C(C)C(O)C1OCCO

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SSTR1 P30872 1/20 0.36
▸ SSTR2 P30874 1/20 0.36
▸ SSTR4 P31391 1/20 0.36
▸ SSTR3 P32745 1/20 0.36
▸ SSTR5 P35346 1/20 0.36
▸ LGALS8 O00214 7/20 0.35
▸ FGF1 P05230 2/20 0.33
▸ TNF P01375 1/20 0.33
▸ GJB2 P29033 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
SCHEMBL18519129 0.90 LGALS8 (0.36) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL16556418 0.87 LGALS8 (0.43) LGALS8FGF1TNF
SCHEMBL19213281 0.85 LGALS8 (0.38) LGALS8
SCHEMBL12219328 0.85 LGALS8 (0.38) LGALS8
SCHEMBL19341669 0.84 FGF1 (0.40) LGALS8FGF1GJB2
SCHEMBL18519128 0.83 TNF (0.36) LGALS8FGF1TNF
SCHEMBL9780103 0.82 SSTR1 (0.49) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL14632200 0.82 SSTR1 (0.49) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL14586218 0.81 LGALS8 (0.33) LGALS8FGF1GJB2
SCHEMBL24436935 0.81 FGF1 (0.39) LGALS8FGF1GJB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170224605-A1 TEMPORARY CHANGING THE COLOR OF HAIR USING PIGMENTS, ALCOHOLS AND CATIONIC CELLULOSES HENKEL AG & CO. KGAA (DE) 2017-08-10 — — 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-20170224605-A1 TEMPORARY CHANGING THE COLOR OF HAIR USING PIGMENTS, ALCOHOLS AND CATIONIC CELLULOSES KRT18, CUTA, TYR SSTR1 4085/4885SSTR2 4341/4885SSTR4 4236/4885

“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.

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