SCHEMBL6804788

SCHEMBL6804788

CCC(c1ccc(S(=O)(=O)c2ccccc2OS(=O)(=O)C(F)(F)F)cc1)N(Cc1ccccc1)C[C@H](O)c1cccc(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.35
CNR1 P21554 9/20 0.34
CYP2C9 P11712 1/20 0.34
GAA P10253 1/20 0.33
TAS2R14 Q9NYV8 1/20 0.32
HSD11B1 P28845 1/20 0.32
LIMK1 P53667 1/20 0.31
LIMK2 P53671 1/20 0.31
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
SPPL2A Q8TCT8 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 1/20 0.31
ADRB2 P07550 1/20 0.31
ADRB3 P13945 1/20 0.31

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
SCHEMBL6804791 0.88 CNR2 (0.38) CNR2PTGDR2CNR1CYP2C9PSEN1
SCHEMBL6804793 0.82 ADRB3 (0.35) CNR2PTGDR2TAS2R14PSEN1PSEN2
SCHEMBL6683518 0.74 ADRB3 (0.46) CYP2C9ADRB2ADRB3
SCHEMBL6683514 0.74 ADRB3 (0.46) CYP2C9ADRB2ADRB3
SCHEMBL6681061 0.73 PSEN1 (0.40) CYP2C9TAS2R14PSEN1PSEN2APH1B
SCHEMBL6681059 0.73 PSEN1 (0.40) CYP2C9TAS2R14PSEN1PSEN2APH1B
SCHEMBL6682179 0.73 CNR2 (0.41) CNR2PTGDR2CNR1CYP2C9ADRB2
SCHEMBL6540726 0.72 L3MBTL1 (0.43) TAS2R14PSEN1PSEN2SPPL2AAPH1B
SCHEMBL6806070 0.72 MEN1 (0.41) CYP2C9GAAADRB2ADRB3
SCHEMBL6805436 0.72 ADRB3 (0.38) TAS2R14ADRB2ADRB3

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 CNR2 73/4885PTGDR2 697/4885CNR1 112/4885

“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.