SCHEMBL6541428

SCHEMBL6541428

COc1ccc(S(=O)(=O)c2ccc(CCN(Cc3ccccc3)C(=O)O)cc2)cc1OC

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.58
TAS2R14 Q9NYV8 1/20 0.53
ALDH1A1 P00352 2/20 0.52
GAA P10253 1/20 0.52
TP53 P04637 1/20 0.51
MAPT P10636 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
POLB P06746 1/20 0.50
TSHR P16473 1/20 0.50
MAPK1 P28482 1/20 0.50
PDE4D Q08499 5/20 0.49
PDE4A P27815 4/20 0.48
PDE4B Q07343 4/20 0.48
PDE4C Q08493 4/20 0.48
LPAR1 Q92633 1/20 0.48
CA12 O43570 2/20 0.47
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA4 P22748 1/20 0.47

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
SCHEMBL6540559 0.85 LPAR1 (0.56) TAS2R14LPAR1CA12CA1CA2
SCHEMBL6540099 0.85 HTR6 (0.55) L3MBTL1TAS2R14ALDH1A1GAALPAR1
SCHEMBL6540116 0.82 TAS2R14 (0.52) TAS2R14ALDH1A1TP53TSHRLPAR1
SCHEMBL6274189 0.81 MEN1 (0.48) MAPK1CA12CA1CA2CA4
SCHEMBL6540100 0.81 L3MBTL1 (0.59) L3MBTL1GAALPAR1
SCHEMBL6798502 0.80 CA12 (0.55) L3MBTL1TAS2R14CA12CA1CA2
SCHEMBL6541013 0.80 CA12 (0.50) CA12CA1CA2CA4
SCHEMBL6554335 0.78 L3MBTL1 (0.46) L3MBTL1TAS2R14ALDH1A1GAATP53
SCHEMBL7419350 0.77 PDE4D (0.67) L3MBTL1TAS2R14ALDH1A1GAATP53
SCHEMBL6540945 0.77 ALDH1A1 (0.55) L3MBTL1ALDH1A1GAAMAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040138462-A1 Aminoalcohol derivatives ASTELLAS PHARMA INC. (JP) 2004-07-15 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-20040138462-A1 Aminoalcohol derivatives BPHL, FANCD2, HRH2 L3MBTL1 2987/4885TAS2R14 3056/4885ALDH1A1 188/4885

“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.