SCHEMBL6541125

SCHEMBL6541125

O=C(O)N(CCc1ccccc1Sc1cccc(O)c1)Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.51
OPRM1 P35372 4/20 0.42
OPRD1 P41143 4/20 0.42
OPRK1 P41145 3/20 0.42
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
SLC6A3 Q01959 2/20 0.39
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C19 P33261 1/20 0.38
GAA P10253 1/20 0.38
GFER P55789 1/20 0.38
LMNA P02545 1/20 0.38
TRPV1 Q8NER1 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
IDO1 P14902 1/20 0.37
SLC6A9 P48067 1/20 0.37

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
SCHEMBL6540657 0.85 OPRK1 (0.52) OPRM1OPRD1OPRK1TRPV1L3MBTL1
SCHEMBL6540825 0.83 OPRK1 (0.50) OPRM1OPRD1OPRK1L3MBTL1
SCHEMBL6540592 0.74 SMN1; SMN2 (0.54) SMN1; SMN2GAA
SCHEMBL6540960 0.73 OPRM1 (0.41) OPRM1OPRD1OPRK1GAAGFER
SCHEMBL6540023 0.73 L3MBTL1 (0.51) L3MBTL1
SCHEMBL10341596 0.72 SLC6A4 (0.69) SMN1; SMN2SLC6A2SLC6A4SLC6A3GAA
Maleic Acid SCHEMBL29711085 0.72 SMN1; SMN2 (0.71) SMN1; SMN2SLC6A2SLC6A4SLC6A3HPGD
SCHEMBL6540922 0.70 L3MBTL1 (0.48) OPRM1OPRD1OPRK1TRPV1L3MBTL1
SCHEMBL6935290 0.69 SMN1; SMN2 (0.60) SMN1; SMN2SLC6A2SLC6A4SLC6A3CYP2C9
SCHEMBL7228409 0.69 MEN1 (0.61) LMNAL3MBTL1

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 SMN1; SMN2 2146/4885OPRM1 180/4885OPRD1 68/4885

“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.