SCHEMBL5863571

SCHEMBL5863571

O=S(=O)(c1ccccc1Cl)N(Cc1ccccc1O)c1ccc(OCCN2CCCC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.47
ESR1 P03372 1/20 0.46
HTR1A P08908 1/20 0.45
HTR7 P34969 1/20 0.45
MCHR1 Q99705 1/20 0.44
HRH3 Q9Y5N1 3/20 0.44
KCNH2 Q12809 1/20 0.43
LTA4H P09960 6/20 0.43
HTT P42858 1/20 0.41
PSMB1 P20618 1/20 0.41
PSMB5 P28074 1/20 0.41
PTGS2 P35354 2/20 0.41
TSHR P16473 1/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL5863915 0.87 PGR (0.54) PGRESR1HTR1AHTR7HRH3
SCHEMBL5864344 0.84 PGR (0.47) PGRESR1HTR1AHTR7HRH3
SCHEMBL5863616 0.81 HRH3 (0.43) ESR1HRH3KCNH2LTA4HHTT
SCHEMBL5863596 0.78 ESR1 (0.46) ESR1HRH3LTA4HPTGS2KDM4E
SCHEMBL5863730 0.78 ESR1 (0.50) ESR1LTA4HHTTKDM4EPOLB
SCHEMBL5863643 0.77 ESR1 (0.49) ESR1LTA4H
SCHEMBL5865382 0.76 LTA4H (0.47) ESR1MCHR1HRH3KCNH2LTA4H
SCHEMBL5863824 0.76 LTA4H (0.47) ESR1MCHR1HRH3KCNH2LTA4H
SCHEMBL5863563 0.76 LTA4H (0.48) PGRESR1MCHR1HRH3KCNH2
SCHEMBL5864016 0.76 MMP1 (0.51) ESR1LTA4HHTT

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 PGR 54/4885ESR1 4/4885HTR1A 1005/4885

“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.