SCHEMBL5864622

SCHEMBL5864622

N#Cc1ccccc1S(=O)(=O)N(Cc1cccc(OC(=O)C(F)(F)F)c1)c1ccc(OCCN2CCCC2)cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.39
RORC P51449 1/20 0.39
MMP1 P03956 1/20 0.38
MMP9 P14780 1/20 0.38
MMP13 P45452 1/20 0.38
ADAM17 P78536 1/20 0.38
LTA4H P09960 8/20 0.38
NR3C1 P04150 2/20 0.38
ESR1 P03372 3/20 0.38
ESR2 Q92731 1/20 0.38
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.37
PTGES O14684 1/20 0.37
ALOX5 P09917 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PGR P06401 1/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 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
Trifluoroacetic Acid SCHEMBL5864618 0.88 HTT (0.43) HTTRORCLTA4HESR1ESR2
SCHEMBL5863685 0.86 HTT (0.44) HTTLTA4HNR3C1ESR1ESR2
SCHEMBL5863421 0.83 HTT (0.44) HTTMMP1MMP9MMP13ADAM17
SCHEMBL5863827 0.82 LTA4H (0.37) LTA4HNR3C1KDM4EALDH1A1SMN1; SMN2
SCHEMBL5864009 0.78 MMP1 (0.51) HTTRORCMMP1MMP9MMP13
SCHEMBL5864023 0.76 HTT (0.47) HTTLTA4HESR1ESR2KDM4E
SCHEMBL5864080 0.75 HTT (0.43) HTTLTA4HNR3C1ESR1ESR2
SCHEMBL5864217 0.73 ESR1 (0.51) HTTMMP1MMP9MMP13ADAM17
SCHEMBL5864108 0.73 MMP1 (0.47) HTTMMP1MMP9MMP13ADAM17
SCHEMBL5863720 0.73 NR3C1 (0.44) HTTLTA4HNR3C1ESR1ESR2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7053212-B2 Acyclic amide and sulfonamide ligands for the estrogen receptor PFIZER INC. (US) 2006-05-30 US disclosed
US-20040110767-A1 Acyclic amide and sulfonamide ligands for the estrogen receptor PFIZER INC 2004-06-10 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-20040110767-A1 Acyclic amide and sulfonamide ligands for the estrogen receptor GHSR, GPER1, SSTR1 HTT 4548/4885RORC 2100/4885MMP1 1746/4885

“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.