SCHEMBL4139311

SCHEMBL4139311

CCCCCCCCCCCC(=O)NC(C)c1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.72
ASAH1 Q13510 2/20 0.72
ACER2 Q5QJU3 1/20 0.72
MAPT P10636 1/20 0.63
CERT1 Q9Y5P4 3/20 0.61
POLB P06746 1/20 0.60
HPGD P15428 1/20 0.59
GAA P10253 1/20 0.59
KMT2A Q03164 2/20 0.58
MEN1 O00255 1/20 0.57
FAAH O00519 1/20 0.57
MAPK1 P28482 1/20 0.57
UGCG Q16739 1/20 0.55

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
SCHEMBL5599045 1.00 ALDH1A1 (0.72) ALDH1A1ASAH1ACER2MAPTCERT1
SCHEMBL16714723 1.00 ALDH1A1 (0.72) ALDH1A1ASAH1ACER2MAPTCERT1
SCHEMBL4183115 1.00 ALDH1A1 (0.72) ALDH1A1ASAH1ACER2MAPTCERT1
SCHEMBL4139305 1.00 ALDH1A1 (0.72) ALDH1A1ASAH1ACER2MAPTCERT1
SCHEMBL12215278 1.00 ALDH1A1 (0.72) ALDH1A1ASAH1ACER2MAPTCERT1
SCHEMBL9472620 1.00 ALDH1A1 (0.72) ALDH1A1ASAH1ACER2MAPTCERT1
SCHEMBL11857445 0.92 SOAT2 (0.64) ALDH1A1ASAH1ACER2MAPTFAAH
SCHEMBL11857434 0.92 SOAT2 (0.64) ALDH1A1ASAH1ACER2MAPTFAAH
SCHEMBL11396580 0.91 ALDH1A1 (0.61) ALDH1A1ASAH1ACER2MAPTCERT1
Melinamide SCHEMBL1650618 0.89 EPHX2 (0.62) ALDH1A1ASAH1ACER2FAAH

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 ALDH1A1 4657/4885ASAH1 3433/4885ACER2 3213/4885

“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.