SCHEMBL4620798

SCHEMBL4620798

Fc1ccc(C2OCc3cc(CBr)ccc32)cc1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 3/20 0.35
HTR2C P28335 4/20 0.31
HTR2A P28223 4/20 0.31
HTR2B P41595 3/20 0.31
SLC6A2 P23975 2/20 0.31
SLC6A4 P31645 2/20 0.31
SLC6A3 Q01959 2/20 0.31
LOXL2 Q9Y4K0 1/20 0.31
SLC5A1 P13866 1/20 0.30

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
SCHEMBL27716154 0.89 SLC5A2 (0.34) SLC5A2
SCHEMBL4622856 0.86 SLC5A2 (0.40) SLC5A2SLC6A2SLC6A4SLC6A3LOXL2
SCHEMBL4622359 0.86 LOXL2 (0.46) SLC5A2HTR2CHTR2AHTR2BSLC6A2
SCHEMBL13970077 0.83 SLC5A2 (0.38) SLC5A2HTR2CHTR2ASLC6A2SLC6A4
SCHEMBL1777 0.81 KDM1A (0.35) SLC6A4
SCHEMBL27508666 0.78 SLC5A2 (0.38) SLC5A2SLC5A1
SCHEMBL27840083 0.78 FADS1 (0.37) HTR2CHTR2AHTR2B
SCHEMBL6096441 0.78 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3
SCHEMBL7163573 0.75 SLC5A2 (0.39) SLC5A2HTR2AHTR2BSLC6A2SLC6A4
SCHEMBL5936386 0.74 MEN1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1296970-B1 METHOD FOR THE PREPARATION OF CITALOPRAM LUNDBECK & CO AS H (DK) 2008-03-19 EP disclosed
US-6660873-B2 Method for the preparation of citalopram H. LUNDBECK A/S (DK) 2003-12-09 US disclosed
US-20030134895-A1 Method for the preparation of citalopram H. LUNDBECK A/S (DK) 2003-07-17 US disclosed
EP-1296970-A1 METHOD FOR THE PREPARATION OF CITALOPRAM H. Lundbeck A/S (DK) 2003-04-02 EP disclosed
WO-2001085712-A1 METHOD FOR THE PREPARATION OF CITALOPRAM H. LUNDBECK A/S (DK) 2001-11-15 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-20030134895-A1 Method for the preparation of citalopram MAOB, MAOA, TPH1 SLC5A2 1388/4885HTR2C 147/4885HTR2A 187/4885

“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.