SCHEMBL14873017

SCHEMBL14873017

CCCC1CCCCC1CCCO

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA4 P22748 1/20 0.56
CYP1A2 P05177 1/20 0.38
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
HSD17B10 Q99714 1/20 0.35
TSHR P16473 1/20 0.35
CNR2 P34972 4/20 0.33
ADRA2A P08913 2/20 0.33
ADRA2B P18089 2/20 0.33
ADRA2C P18825 2/20 0.33
ADRA1A P35348 1/20 0.33
MME P08473 1/20 0.33

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
SCHEMBL11350817 0.88 CA1 (0.37) CA1CA2CA4
SCHEMBL11350814 0.88 CA1 (0.37) CA1CA2CA4
SCHEMBL18543689 0.88 CA1 (0.37) CA1CA2CA4
SCHEMBL13766711 0.86 CA1 (0.60) CA1CA2CA4CYP1A2MEN1
SCHEMBL18543679 0.83 CA1 (0.34) CA1CA2CA4
SCHEMBL10771181 0.83 CA1 (0.34) CA1CA2CA4
SCHEMBL18543687 0.83 CA1 (0.34) CA1CA2CA4
SCHEMBL10771228 0.83 CA1 (0.32) CA1CA2CA4
SCHEMBL11591596 0.83 CA1 (0.67) CA1CA2CA4CYP1A2MEN1
SCHEMBL18543667 0.81 TDP1 (0.39) CA1CA2CA4

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-20130096324-A1 PROCESS FOR PREPARING OPTICALLY ACTIVE ANTROCIN DEYEW BIOTECH CORP. (TW) 2013-04-18 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-20130096324-A1 PROCESS FOR PREPARING OPTICALLY ACTIVE ANTROCIN KTN1, TMSB10, TSN CA1 1618/4885CA2 3544/4885CA4 2469/4885

“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.