SCHEMBL7030463

SCHEMBL7030463

CC(CCOC(=O)OCC(N)C(=O)O)CCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.52
SLC1A5 Q15758 1/20 0.43
GRIK1 P39086 1/20 0.43
ALPI P09923 1/20 0.42
PKM P14618 1/20 0.42
PTGS1 P23219 1/20 0.42
XIAP P98170 1/20 0.42
SLC7A5 Q01650 1/20 0.42
IL1RN P18510 2/20 0.41
ERAP2 Q6P179 2/20 0.41
ERAP1 Q9NZ08 2/20 0.41
LTA4H P09960 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TSHR P16473 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
SCHEMBL7029223 0.85 IDO1 (0.56) IDO1SLC1A5GRIK1ALPIPKM
SCHEMBL13047077 0.82 TSHR (0.50) SMN1; SMN2TSHR
SCHEMBL31149440 0.79 SMN1; SMN2 (0.51) SMN1; SMN2TSHR
SCHEMBL7030449 0.78 CA12 (0.48) SMN1; SMN2
SCHEMBL14435224 0.78 IDO1 (0.58) IDO1SLC1A5GRIK1ALPIPKM
SCHEMBL6559718 0.78 ALDH1A1 (0.51) SMN1; SMN2TSHR
SCHEMBL27556300 0.78 ALDH1A1 (0.51) SMN1; SMN2TSHR
SCHEMBL5186550 0.76 ALDH1A1 (0.50) SMN1; SMN2TSHR
SCHEMBL1370980 0.76 IDO1 (0.57) IDO1SLC1A5ALPIPKMPTGS1
SCHEMBL1370981 0.76 IDO1 (0.57) IDO1SLC1A5ALPIPKMPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6569411-B2 Deodoring, microbiocides, marking odors THE GILLETTE COMPANY 2003-05-27 US disclosed
US-20030018055-A1 Serine carbonates FRATER GEORGE (CH) 2003-01-23 US disclosed
EP-1053223-A1 SERINE CARBONATES Givaudan SA (CH) 2000-11-22 EP disclosed
WO-2000034232-A1 SERINE CARBONATES GIVAUDAN SA (CH) 2000-06-15 WO disclosed
EP-1008587-A1 Serine carbonates Givaudan Roure (International) S.A. (CH) 2000-06-14 EP 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-20030018055-A1 Serine carbonates SRR, ME1, TASP1 IDO1 1943/4885SLC1A5 1853/4885GRIK1 1937/4885

“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.