SCHEMBL5864101

SCHEMBL5864101

CC(c1ccc(O)cc1)N(c1ccc(OCCN2CCCC2)cc1)S(=O)(=O)c1ccccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 5/20 0.46
PSEN2 P49810 5/20 0.46
APH1B Q8WW43 5/20 0.46
NCSTN Q92542 5/20 0.46
APH1A Q96BI3 5/20 0.46
PSENEN Q9NZ42 5/20 0.46
LTA4H P09960 1/20 0.45
PSMB1 P20618 1/20 0.45
PSMB5 P28074 1/20 0.45
ESR1 P03372 8/20 0.45
ESR2 Q92731 7/20 0.45
ALDH1A1 P00352 1/20 0.43
HRH3 Q9Y5N1 2/20 0.43
HTR1A P08908 1/20 0.43
HTR7 P34969 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL5864067 0.84 HTR1A (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5863681 0.81 PSMB1 (0.46) PSMB1PSMB5ESR1ESR2ALDH1A1
SCHEMBL5863915 0.81 PGR (0.54) LTA4HESR1ESR2HRH3HTR1A
SCHEMBL5863571 0.75 PGR (0.47) LTA4HPSMB1PSMB5ESR1HRH3
SCHEMBL5864344 0.73 PGR (0.47) LTA4HESR1HRH3HTR1AHTR7
SCHEMBL5863577 0.73 MMP1 (0.50) PSMB1PSMB5ESR1ESR2ALDH1A1
SCHEMBL5864016 0.72 MMP1 (0.51) LTA4HESR1ESR2
SCHEMBL5863824 0.70 LTA4H (0.47) LTA4HESR1ESR2HRH3
SCHEMBL5865382 0.70 LTA4H (0.47) LTA4HESR1ESR2HRH3MEN1
SCHEMBL2475993 0.69 ESR1 (0.75) LTA4HPSMB1PSMB5ESR1ESR2

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 PSEN1 1564/4885PSEN2 2249/4885APH1B 1809/4885

“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.