SCHEMBL6804957

SCHEMBL6804957

C[C@H](Cc1ccc(S(=O)(=O)c2ccc(O)cc2Cl)cc1)NC(=O)C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.44
ABCC9 O60706 3/20 0.43
ABCC8 Q09428 3/20 0.43
KCNJ11 Q14654 3/20 0.43
KCNJ8 Q15842 3/20 0.43
HSD11B1 P28845 10/20 0.43
CNR2 P34972 1/20 0.40
PDK1 Q15118 1/20 0.40
PDK2 Q15119 1/20 0.40
PDK3 Q15120 1/20 0.40
PDK4 Q16654 1/20 0.40
ACACB O00763 2/20 0.39
ESR1 P03372 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL6800924 0.87 CNR1 (0.58) CNR1ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6541437 0.85 ESR1 (0.46) CNR1ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6539913 0.85 ESR1 (0.46) CNR1ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6806687 0.85 CNR1 (0.51) CNR1ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6679820 0.85 CNR1 (0.47) CNR1ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6676950 0.83 ACACB (0.43) CNR1ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6810020 0.83 ABCB11 (0.41) CNR1ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6540648 0.83 ABCB11 (0.41) CNR1ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6540275 0.81 ABCC9 (0.55) CNR1ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL8986825 0.79 ESR1 (0.54) ACACBESR1KCNH2

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 CNR1 112/4885ABCC9 1596/4885ABCC8 997/4885

“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.