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Sugi Predict / Compounds / SCHEMBL15905907

SCHEMBL15905907

SCHEMBL15905907

CCC(CC(CC(CC(CC(C)OC(C)=O)OC(C)=O)OC(C)=O)NC=O)OC(C)=O

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.33
▸ CHRM2 P08172 1/20 0.33
▸ CHRM4 P08173 1/20 0.33
▸ CHRM1 P11229 1/20 0.33
▸ TBXA2R P21731 1/20 0.33
▸ GALR3 O60755 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ CTSK P43235 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
SCHEMBL15031021 0.93 TSHR (0.34) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL19760880 0.84 TSHR (0.44) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL10168449 0.84 TSHR (0.44) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL15725513 0.84 TSHR (0.44) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL10065668 0.81 TSHR (0.47) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL12574756 0.79 CTSK (0.32) CTSK
SCHEMBL17358635 0.78 TSHR (0.50) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL12238747 0.77 — —
SCHEMBL12238746 0.74 ADH1B (0.33) TSHRCTSK
SCHEMBL15905673 0.72 — —

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-8790632-B2 Polymer-based tissue-adhesive form medical use ACTAMAX SURGICAL MATERIALS, LLC (US) 2014-07-29 — — US disclosed