SCHEMBL7129037

SCHEMBL7129037

CCCC(Oc1ccccc1CC1CO1)Oc1ccccc1CC1CO1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
GLA P06280 1/20 0.40
ADRA2A P08913 6/20 0.37
ADRA2B P18089 6/20 0.37
ADRA2C P18825 6/20 0.37
HTR1A P08908 4/20 0.37
KCNH2 Q12809 1/20 0.37
DRD4 P21917 2/20 0.37
SLC6A2 P23975 3/20 0.33
HRH3 Q9Y5N1 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CYP2D6 P10635 3/20 0.32
TSHR P16473 1/20 0.32
CTSB P07858 1/20 0.32
SLC6A4 P31645 1/20 0.31

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
SCHEMBL3910226 0.84 DRD4 (0.38) ALDH1A1GLAADRA2AADRA2BADRA2C
SCHEMBL7123428 0.81 ALDH1A1 (0.44) ALDH1A1GLAADRA2AADRA2BADRA2C
SCHEMBL3910102 0.80 ALDH1A1 (0.38) ALDH1A1GLAADRA2AADRA2BADRA2C
SCHEMBL14199651 0.77 ALDH1A1 (0.46) ALDH1A1GLAHTR1AKCNH2DRD4
SCHEMBL14199653 0.76 DRD4 (0.51) ALDH1A1GLAHTR1ADRD4SLC6A2
SCHEMBL7114249 0.76 CYP2D6 (0.50) ALDH1A1GLAKCNH2SLC6A2HRH3
SCHEMBL3372443 0.76 ALDH1A1 (0.46) ALDH1A1GLADRD4SLC6A2TDP1
SCHEMBL1312619 0.76 ALDH1A1 (0.46) ALDH1A1GLADRD4SLC6A2TDP1
SCHEMBL6305830 0.76 ALDH1A1 (0.46) ALDH1A1GLADRD4SLC6A2TDP1
SCHEMBL7123430 0.73 ALDH1A1 (0.47) ALDH1A1GLAADRA2AADRA2BADRA2C

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-6670474-B2 Such as bis-1,2-(2-(2,3-epoxypropyl)phenoxy)ethane; chemical intermediates for formation of epoxy resins PEWS R GARTH (US) 2003-12-30 US claimed
US-20020151731-A1 Novel epoxide derivatives of allylarylphenols PEWS R GARTH (US) 2002-10-17 US claimed

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-20020151731-A1 Novel epoxide derivatives of allylarylphenols EPHX2, CBR3, CYP4X1 ALDH1A1 578/4885GLA 2736/4885ADRA2A 223/4885

“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.