SCHEMBL5889866

SCHEMBL5889866

CCOC(CC1CO1)OCC

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.34
ALDH1A1 P00352 5/20 0.33
THRB P10828 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 2/20 0.31
MAPK1 P28482 1/20 0.31
TP53 P04637 1/20 0.30
HBB P68871 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
SCHEMBL17049376 0.79
SCHEMBL10448589 0.74 ALDH1A1 (0.39) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL28680876 0.74 ALDH1A1 (0.35) SMN1; SMN2ALDH1A1TDP1
SCHEMBL11324700 0.73 SMN1; SMN2 (0.33) SMN1; SMN2ALDH1A1TDP1
SCHEMBL29234277 0.73 SMN1; SMN2 (0.37) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL29069306 0.73 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL11327083 0.73 ALDH1A1 (0.38) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL12568607 0.73 ALDH1A1 (0.50) SMN1; SMN2ALDH1A1TDP1
SCHEMBL11938274 0.71 ALDH1A1 (0.47) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
Hydrochloric Acid SCHEMBL10775397 0.70 CHRM2 (0.35) TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7060477-B2 Epoxide hydrolases of aspergillus origin CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2006-06-13 US disclosed
US-20030143710-A1 Epoxide hydrolases of aspergillus origin UNIVERSITE DE LA MEDITERRANEE (FR) 2003-07-31 US disclosed
US-4904679-A Pyrrolophenylalkanolamines as animal yield promoters BAYER AKTIENGESELLSCHAFT (DE) 1990-02-27 US disclosed
EP-0289850-A2 Pyrrololphenylalkanol amines and their derivatives, process for their preparation and their use as performance promotors BAYER AG (DE) 1988-11-09 EP 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-20030143710-A1 Epoxide hydrolases of aspergillus origin EPHX1, EPHX2, ERG28 SMN1; SMN2 4878/4885ALDH1A1 475/4885THRB 4736/4885

“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.