SCHEMBL13583306

SCHEMBL13583306

O=C(N[C@@H](CS(=O)(=O)O)C(=O)O)C(O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
MAPK1 P28482 1/20 0.46
SRC P12931 1/20 0.45
KEAP1 Q14145 1/20 0.45
NFE2L2 Q16236 1/20 0.45
NAAA Q02083 2/20 0.44
PSMB5 P28074 1/20 0.42
MME P08473 6/20 0.42
ACE2 Q9BYF1 1/20 0.42
NAALAD2 Q9Y3Q0 1/20 0.40
NPC1 O15118 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
CASP1 P29466 2/20 0.40
CASP3 P42574 2/20 0.40
CASP7 P55210 2/20 0.40
CASP8 Q14790 2/20 0.40
PSEN1 P49768 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
SCHEMBL27888056 1.00 LMNA (0.46) LMNAMAPK1SRCKEAP1NFE2L2
SCHEMBL13583608 0.85 ENPEP (0.46) LMNAMAPK1SRCKEAP1NFE2L2
SCHEMBL27871926 0.85 KEAP1 (0.47) SRCKEAP1NFE2L2MMEACE2
SCHEMBL13583345 0.85 KEAP1 (0.47) SRCKEAP1NFE2L2MMEACE2
SCHEMBL27871806 0.84 MMP8 (0.50) LMNAKEAP1NFE2L2NAAAPSMB5
SCHEMBL13583480 0.84 MMP8 (0.50) LMNAKEAP1NFE2L2NAAAPSMB5
SCHEMBL2327018 0.84 MME (0.49) MMEACE2
SCHEMBL27987163 0.84 MME (0.41) SRCMMEACE2NAALAD2NPC1
SCHEMBL2327014 0.84 MME (0.49) MMEACE2
SCHEMBL27871807 0.84 MME (0.41) SRCMMEACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2524686-B1 PIGMENTATION-PREVENTING OR -AMELIORATING AGENT POLA CHEM IND INC (JP) 2017-06-21 EP disclosed
US-9066914-B2 Prophylactic or ameliorating agent for pigmentation POLA CHEMICAL INDUSTRIES INC. (JP) 2015-06-30 US disclosed
EP-2524686-A1 PIGMENTATION-PREVENTING OR -AMELIORATING AGENT Pola Chemical Industries Inc. (JP) 2012-11-21 EP disclosed
US-20120282203-A1 PROPHYLACTIC OR AMELIORATING AGENT FOR PIGMENTATION POLA CHEMICAL INDUSTRIES INC. (JP) 2012-11-08 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-20120282203-A1 PROPHYLACTIC OR AMELIORATING AGENT FOR PIGMENTATION TYR, MC1R, NQO1 LMNA 2058/4885MAPK1 594/4885SRC 2231/4885

“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.