SCHEMBL6804793

SCHEMBL6804793

O=S(=O)(c1ccc(CCCN(Cc2ccccc2)C[C@@H](O)c2cccc(Cl)c2)cc1)c1ccccc1OS(=O)(=O)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 4/20 0.35
CNR2 P34972 1/20 0.35
CA12 O43570 4/20 0.34
CA1 P00915 4/20 0.34
CA2 P00918 4/20 0.34
CA4 P22748 2/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
CCR5 P51681 1/20 0.34
BCHE P06276 1/20 0.33
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
SPPL2A Q8TCT8 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33
NR1H3 Q13133 1/20 0.33
ADRB1 P08588 2/20 0.33
LPAR1 Q92633 1/20 0.33
LPAR5 Q9H1C0 1/20 0.33

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
SCHEMBL6805431 0.90 ADRB3 (0.38) ADRB3CA12CA1CA2BCHE
SCHEMBL6805436 0.90 ADRB3 (0.38) ADRB3CA12CA1CA2BCHE
SCHEMBL6805663 0.88 PGR (0.37) ADRB3CA12CA1CA2CCR5
SCHEMBL6805657 0.88 PGR (0.37) ADRB3CA12CA1CA2CCR5
SCHEMBL6540726 0.84 L3MBTL1 (0.43) ADRB3PSEN1PSEN2SPPL2AAPH1B
SCHEMBL6679661 0.84 KCNH2 (0.38) ADRB3CA12CA1CA2CA4
SCHEMBL6679662 0.84 KCNH2 (0.38) ADRB3CA12CA1CA2CA4
SCHEMBL6804791 0.83 CNR2 (0.38) ADRB3CNR2PTGDR2PSEN1PSEN2
SCHEMBL6539489 0.82 ADRB3 (0.39) ADRB3CA12CA1CA2CA4
SCHEMBL6540463 0.82 PSEN1 (0.39) ADRB3CA12CA1CA2CA4

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-20040106653-A1 Aminoalcohol derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-03 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-20040106653-A1 Aminoalcohol derivatives FANCD2, FANCI, HRH2 ADRB3 150/4885CNR2 73/4885CA12 1959/4885

“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.