SCHEMBL6540822

SCHEMBL6540822

O=C(O)N(Cc1ccccc1)Cc1ccc(S(=O)(=O)c2ccc(O)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 5/20 0.57
ESR1 P03372 2/20 0.55
FNTA P49354 1/20 0.51
FNTB P49356 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.49
PRMT1 Q99873 1/20 0.45
HSD11B1 P28845 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TSHR P16473 1/20 0.45
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
SERPINE1 P05121 1/20 0.44
CA4 P22748 1/20 0.44
HTR6 P50406 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL6798502 0.90 CA12 (0.55) TAS2R14ESR1L3MBTL1CA12CA1
SCHEMBL6540370 0.89 ESR1 (0.51) TAS2R14ESR1CA12CA1CA2
SCHEMBL375755 0.88 FNTA (0.59) TAS2R14ESR1FNTAFNTBMEN1
SCHEMBL6539996 0.82 HTR6 (0.51) TAS2R14ESR1L3MBTL1CA12CA1
SCHEMBL6799685 0.82 ESR1 (0.45) TAS2R14ESR1MEN1KMT2ATSHR
SCHEMBL6539989 0.79 FNTA (0.49) TAS2R14ESR1FNTAFNTBMEN1
SCHEMBL6541013 0.79 CA12 (0.50) CA12CA1CA2CA4HTR6
SCHEMBL825414 0.78 LMNA (0.63) MEN1KMT2ATSHRCA12LMNA
SCHEMBL6541359 0.78 TAS2R14 (0.48) TAS2R14ESR1FNTAFNTBMEN1
SCHEMBL7929144 0.78 HTR6 (0.55) TAS2R14ESR1FNTAFNTBL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040138462-A1 Aminoalcohol derivatives ASTELLAS PHARMA INC. (JP) 2004-07-15 US disclosed
EP-1389185-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-02-18 EP disclosed
WO-2002094770-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-28 WO 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-20040138462-A1 Aminoalcohol derivatives BPHL, FANCD2, HRH2 TAS2R14 3056/4885ESR1 2525/4885FNTA 3666/4885

“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.