SCHEMBL5863837

SCHEMBL5863837

Cc1cccc(C(=O)N(c2ccc(OCCN3CCCC3)cc2)C(Cl)c2ccc(OC3CCCCO3)cc2)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
ESR1 P03372 5/20 0.37
ESR2 Q92731 2/20 0.37
HRH2 P25021 1/20 0.37
HRH1 P35367 1/20 0.37
PSMB1 P20618 3/20 0.36
GCGR P47871 1/20 0.36
PSMB5 P28074 2/20 0.36
HRH3 Q9Y5N1 2/20 0.36
PSMB2 P49721 1/20 0.36
LDHA P00338 1/20 0.36
KCNH2 Q12809 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL5864049 0.83 TP53 (0.40) LTA4HL3MBTL1ESR1ESR2HRH2
SCHEMBL5864059 0.73 PSMB1 (0.39) ESR1ESR2PSMB1PSMB5HRH3
SCHEMBL5863871 0.72 LTA4H (0.39) LTA4HL3MBTL1ESR1PSMB1PSMB5
SCHEMBL5863668 0.72 KDR (0.60) LTA4HHRH3MEN1KMT2A
SCHEMBL5864067 0.71 HTR1A (0.41) LTA4HPSMB1PSMB5HRH3KCNH2
SCHEMBL5863865 0.70 PDK1 (0.44) LTA4HHRH3KCNH2
SCHEMBL5863669 0.70 PSMB1 (0.49) LTA4HPSMB1PSMB5HRH3PSMB2
SCHEMBL5864259 0.70 MCHR1 (0.55) LTA4HL3MBTL1PSMB1PSMB5HRH3
SCHEMBL5863902 0.70 KDM4E (0.40) ESR1ESR2PSMB1PSMB5HRH3
SCHEMBL5864090 0.69 MMP1 (0.42) LTA4HPSMB1PSMB5HRH3PSMB2

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 LTA4H 1687/4885L3MBTL1 4622/4885ESR1 4/4885

“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.