SCHEMBL6540139

SCHEMBL6540139

COc1ccc(S(=O)(=O)c2ccc(CC(C)(C)NC(=O)C(F)(F)F)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.50
CNR1 P21554 1/20 0.49
MMP13 P45452 10/20 0.48
MMP9 P14780 10/20 0.48
MMP1 P03956 9/20 0.48
PKM P14618 2/20 0.47
GAA P10253 1/20 0.46
MMP2 P08253 1/20 0.43
MMP12 P39900 1/20 0.43
EGFR P00533 1/20 0.43
ERBB2 P04626 1/20 0.43
ABCC9 O60706 1/20 0.42
ABCC8 Q09428 1/20 0.42
KCNJ11 Q14654 1/20 0.42
KCNJ8 Q15842 1/20 0.42
CNR2 P34972 1/20 0.42

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
SCHEMBL6541332 0.88 CXCR2 (0.39) HSD11B1CNR1MMP13MMP9MMP1
SCHEMBL6539832 0.86 ALDH1A1 (0.57) MMP13MMP9MMP1GAA
SCHEMBL6540818 0.86 MEN1 (0.46) PKMGAAABCC9ABCC8KCNJ11
SCHEMBL6540200 0.81 KMT2A (0.46) PKMGAA
SCHEMBL6540103 0.80 ALDH1A1 (0.41) MMP13MMP9MMP1CNR2
SCHEMBL6540374 0.78 AKR1C3 (0.42) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6541474 0.77 POLB (0.50)
SCHEMBL6541208 0.77 CNR1 (0.56) HSD11B1CNR1PKMGAA
SCHEMBL16341200 0.75 ACACB (0.60) MMP13MMP1
SCHEMBL6540252 0.74 ALDH1A1 (0.45) MMP2MMP12

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 HSD11B1 1368/4885CNR1 45/4885MMP13 3026/4885

“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.