SCHEMBL6540275

SCHEMBL6540275

C[C@H](Cc1ccc(S(=O)(=O)c2cccc(O)c2)cc1)NC(=O)C(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 7/20 0.55
ABCC8 Q09428 7/20 0.55
KCNJ11 Q14654 7/20 0.55
KCNJ8 Q15842 7/20 0.55
ESR1 P03372 1/20 0.45
KCNH2 Q12809 1/20 0.45
CNR1 P21554 2/20 0.39
GAA P10253 1/20 0.39
ACACB O00763 2/20 0.39
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
TSHR P16473 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
HSD11B1 P28845 1/20 0.38
LMNA P02545 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
SCHEMBL6539913 0.88 ESR1 (0.46) ABCC9ABCC8KCNJ11KCNJ8ESR1
SCHEMBL6541437 0.88 ESR1 (0.46) ABCC9ABCC8KCNJ11KCNJ8ESR1
SCHEMBL6540898 0.86 ABCC9 (0.57) ABCC9ABCC8KCNJ11KCNJ8ESR1
SCHEMBL6540415 0.84 CNR1 (0.40) ABCC9ABCC8KCNJ11KCNJ8ESR1
SCHEMBL6540853 0.84 ESR1 (0.42) ABCC9ABCC8KCNJ11KCNJ8ESR1
SCHEMBL6799811 0.84 ABCC9 (0.45) ABCC9ABCC8KCNJ11KCNJ8ESR1
SCHEMBL6552531 0.84 ESR1 (0.46) ABCC9ABCC8KCNJ11KCNJ8ESR1
SCHEMBL6540797 0.84 ABCC9 (0.45) ABCC9ABCC8KCNJ11KCNJ8ESR1
SCHEMBL6540648 0.83 ABCB11 (0.41) ABCC9ABCC8KCNJ11KCNJ8ESR1
SCHEMBL6810020 0.83 ABCB11 (0.41) ABCC9ABCC8KCNJ11KCNJ8ESR1

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 ABCC9 1823/4885ABCC8 629/4885KCNJ11 79/4885

“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.