SCHEMBL13870931

SCHEMBL13870931

O=C(Nc1ccccc1C(=O)O)c1cccc(S(=O)(=O)N2CCCCC2)c1

nearest known ligand 0.98

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.98
ALDH1A1 P00352 4/20 0.80
MAPT P10636 4/20 0.80
ALB P02768 1/20 0.80
SMN1; SMN2 Q16637 3/20 0.73
PPARG P37231 1/20 0.72
PPARD Q03181 1/20 0.72
MEN1 O00255 4/20 0.71
KMT2A Q03164 4/20 0.71
GAA P10253 3/20 0.70
NPC1 O15118 1/20 0.69
RAB9A P51151 1/20 0.69
POLB P06746 1/20 0.67
TSHR P16473 2/20 0.64
LMNA P02545 1/20 0.63
MAPK1 P28482 1/20 0.63
HSD17B10 Q99714 1/20 0.63
L3MBTL1 Q9Y468 2/20 0.63
IL1RN P18510 1/20 0.63
HTT P42858 1/20 0.63

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
SCHEMBL13870909 0.99 TP53 (1.00) TP53ALDH1A1MAPTALBSMN1; SMN2
SCHEMBL13870890 0.89 ALB (1.00) TP53ALDH1A1ALBSMN1; SMN2PPARG
SCHEMBL17479208 0.87 TP53 (0.75) TP53ALDH1A1MAPTALBSMN1; SMN2
SCHEMBL17479094 0.86 MEN1 (0.79) TP53ALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL1001462 0.86 TP53 (0.73) TP53ALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL6357153 0.86 ALB (0.83) TP53ALDH1A1MAPTALBSMN1; SMN2
SCHEMBL15076663 0.85 TP53 (0.72) TP53ALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL1095203 0.84 ALDH1A1 (1.00) TP53ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL1000557 0.84 ALDH1A1 (1.00) TP53ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL6350731 0.84 TP53 (0.71) TP53ALDH1A1MAPTALBSMN1; SMN2

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-20090105218-A1 CRTH2 Receptor Ligands For Therapeutic Use 7TM PHARMA A/S (DK) 2009-04-23 US disclosed
US-20090105218-A1 CRTH2 Receptor Ligands For Therapeutic Use 7TM PHARMA A/S (DK) 2009-04-23 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-20090105218-A1 CRTH2 Receptor Ligands For Therapeutic Use NR1H2, NR1H3, HRH2 TP53 4629/4885ALDH1A1 787/4885MAPT 4833/4885

“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.