SCHEMBL18091192

SCHEMBL18091192

CC(=O)CC(N)C(=O)OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.58
SLC15A1 P46059 2/20 0.52
ALPI P09923 1/20 0.49
PKM P14618 1/20 0.49
PTGS1 P23219 1/20 0.49
XIAP P98170 1/20 0.49
SLC7A5 Q01650 1/20 0.49
IDO1 P14902 1/20 0.48
KMT2A Q03164 2/20 0.47
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
LTA4H P09960 1/20 0.46
LAP3 P28838 1/20 0.46
SLC1A1 P43005 4/20 0.45
SLC1A3 P43003 3/20 0.45
SLC1A2 P43004 2/20 0.45
MEN1 O00255 1/20 0.45

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
SCHEMBL15886220 1.00 ALDH1A1 (0.58) ALDH1A1SLC15A1ALPIPKMPTGS1
SCHEMBL15198796 1.00 ALDH1A1 (0.58) ALDH1A1SLC15A1ALPIPKMPTGS1
Hydrochloric Acid SCHEMBL7031969 0.98 ALDH1A1 (0.56) ALDH1A1SLC15A1ALPIPKMPTGS1
SCHEMBL304415 0.86 LTA4H (0.54) ALDH1A1SLC15A1ALPIPKMPTGS1
SCHEMBL169622 0.86 LTA4H (0.54) ALDH1A1SLC15A1ALPIPKMPTGS1
SCHEMBL27873595 0.86 LTA4H (0.54) ALDH1A1SLC15A1ALPIPKMPTGS1
SCHEMBL14514418 0.85 ALDH1A1 (0.50) ALDH1A1SLC15A1ALPIPKMPTGS1
SCHEMBL589202 0.85 SLC15A1 (0.61) ALDH1A1SLC15A1ALPIPKMPTGS1
SCHEMBL589203 0.85 SLC15A1 (0.61) ALDH1A1SLC15A1ALPIPKMPTGS1
Hydrochloric Acid SCHEMBL6506547 0.85 LTA4H (0.52) ALDH1A1SLC15A1ALPIPKMPTGS1

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104524576-A Use of aminolevulinic acid and derivatives thereof PHOTOCURE ASA 2015-04-22 CN claimed
CN-101896203-A Use of solid forms of 5-aminolevulinic acid and derivatives in photodynamic therapy and diagnosis PHOTOCURE ASA 2010-11-24 CN claimed
CN-101631541-A Application of aminolevulinic acid and derivatives thereof PHOTOCURE ASA 2010-01-20 CN claimed
CN-1318388-C Esters of 5-aminolevulinic acid as photosensitizing agents in photochemotherapy PHOTOCURE A S (NO) 2007-05-30 CN claimed
US-20220244263-A1 METHODS FOR TREATING SMALL CELL NEUROENDOCRINE AND RELATED CANCERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-08-04 US disclosed
US-9937152-B2 Derivative of styrene-maleic acid copolymer Maeda, Hiroshi (JP) 2018-04-10 US disclosed
US-20160317672-A1 DERIVATIVE OF STYRENE-MALEIC ACID COPOLYMER Maeda, Hiroshi (JP) 2016-11-03 US disclosed
EP-3072910-A1 DERIVATIVE OF STYRENE-MALEIC ACID COPOLYMER Maeda, Hiroshi (JP) 2016-09-28 EP disclosed
CN-104524576-A Use of aminolevulinic acid and derivatives thereof PHOTOCURE ASA 2015-04-22 CN disclosed
CN-104306968-A Use of 5-aminolevulinic acid and derivatives in a solid form for photodynamic treatment and diagnosis PHOTOCURE ASA 2015-01-28 CN disclosed
CN-104069493-A Use of aminolevulinic acid and derivatives thereof PHOTOCURE ASA 2014-10-01 CN disclosed
CN-101896203-A Use of solid forms of 5-aminolevulinic acid and derivatives in photodynamic therapy and diagnosis PHOTOCURE ASA 2010-11-24 CN disclosed
CN-101631541-A Application of aminolevulinic acid and derivatives thereof PHOTOCURE ASA 2010-01-20 CN 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-20160317672-A1 DERIVATIVE OF STYRENE-MALEIC ACID COPOLYMER ME3, SMN1; SMN2, SMC1A ALDH1A1 174/4885SLC15A1 3872/4885ALPI 3894/4885

“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.