SCHEMBL4141679

SCHEMBL4141679

CCCCCCCCOC(C)C(N)=O

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.53
EPHX1 P07099 2/20 0.48
NAAA Q02083 1/20 0.45
HTT P42858 1/20 0.44
CES2 O00748 1/20 0.44
LMNA P02545 2/20 0.42
NPC1 O15118 1/20 0.42
MAPT P10636 1/20 0.42
RAB9A P51151 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MMP9 P14780 1/20 0.42
MMP8 P22894 1/20 0.42
MMP13 P45452 1/20 0.42
TLR2 O60603 1/20 0.42
TSHR P16473 2/20 0.41
LPAR1 Q92633 1/20 0.41
LPAR3 Q9UBY5 1/20 0.41

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
SCHEMBL8639866 0.98 DNM1 (0.50) DNM1EPHX1NAAAHTTCES2
SCHEMBL7673548 0.91 CA1 (0.43) DNM1EPHX1LMNANPC1MAPT
SCHEMBL1656553 0.91 DNM1 (0.40) DNM1EPHX1NAAAHTTNPC1
SCHEMBL9322459 0.85 DNM1 (0.50) DNM1EPHX1NAAACES2LMNA
Furan SCHEMBL27720855 0.84 DNM1 (0.40) DNM1EPHX1LMNANPC1MAPT
SCHEMBL6580840 0.83 DNM1 (0.48) DNM1NAAACES2MAPTTSHR
SCHEMBL7784786 0.83 DNM1 (0.48) DNM1NAAACES2MAPTTSHR
SCHEMBL9689014 0.83 DNM1 (0.48) DNM1NAAACES2MAPTTSHR
SCHEMBL9508153 0.83 DNM1 (0.48) DNM1NAAACES2MAPTTSHR
SCHEMBL11760703 0.83 DNM1 (0.48) DNM1NAAACES2MAPTTSHR

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-20090192192-A1 INHIBITORS OF BIOFILM FORMATION OF GRAM-POSITIVE AND GRAM-NEGATIVE BACTERIA TOUCH BIONICS LIMITED (GB) 2009-07-30 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-20090192192-A1 INHIBITORS OF BIOFILM FORMATION OF GRAM-POSITIVE AND GRAM-NEGATIVE BACTERIA PGLS, TFPI, Q6ZSR9 DNM1 371/4885EPHX1 4403/4885NAAA 213/4885

“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.