SCHEMBL9912765

SCHEMBL9912765

CCCCCOC(=O)CCC(=O)CNCl

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.61
FAAH O00519 2/20 0.50
NAAA Q02083 1/20 0.50
DGKA P23743 1/20 0.50
PRSS1 P07477 1/20 0.44
PRSS2 P07478 1/20 0.44
PRSS3 P35030 1/20 0.44
RAD52 P43351 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
EPHX1 P07099 1/20 0.43
EPHX2 P34913 5/20 0.43
DNM1 Q05193 1/20 0.42
MGLL Q99685 1/20 0.41
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 1/20 0.40
CNR1 P21554 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40

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
SCHEMBL9912809 0.95 HTR2C (0.54) HTR2CFAAHNAAADGKAPRSS1
SCHEMBL19556 0.82 HTR2C (0.71) HTR2CFAAHNAAADGKAPRSS1
SCHEMBL13855617 0.80 TSHR (0.44) HTR2CDGKAEPHX2ALDH1A1MAPT
SCHEMBL18995 0.80 NAAA (0.75) HTR2CFAAHNAAADGKAPRSS1
SCHEMBL37191 0.80 NAAA (0.75) HTR2CFAAHNAAADGKAPRSS1
SCHEMBL886889 0.80 NAAA (0.75) HTR2CFAAHNAAADGKAPRSS1
SCHEMBL54522 0.80 NAAA (0.75) HTR2CFAAHNAAADGKAPRSS1
SCHEMBL339256 0.80 NAAA (0.75) HTR2CFAAHNAAADGKAPRSS1
SCHEMBL333336 0.80 NAAA (0.75) HTR2CFAAHNAAADGKAPRSS1
SCHEMBL187664 0.80 NAAA (0.75) HTR2CFAAHNAAADGKAPRSS1

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-8198325-B2 Unsaturated alkyl esters of 5-aminolevulinic acid, their preparation and their use INDUSTRY FOUNDATION OF CHONNAM NATIONAL UNIVERSITY (KR) 2012-06-12 US disclosed
US-20090176881-A1 Unsaturated Alkyl Esters of 5-Aminolevulinic Acid, their Preparation and their Use INDUSTRY FOUNDATION OF CHONNAM NATIONAL UNIVERSITY (KR) 2009-07-09 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-20090176881-A1 Unsaturated Alkyl Esters of 5-Aminolevulinic Acid, their Preparation and their Use ALAD, ALOX5, SLC7A1 HTR2C 1116/4885FAAH 873/4885NAAA 2033/4885

“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.