SCHEMBL4095835

SCHEMBL4095835

NCCCC1(c2ccc(F)cc2)OCc2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 7/20 0.53

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
SCHEMBL2873710 0.89 SLC6A4 (0.51) SLC6A4
SCHEMBL9721858 0.86 SLC6A4 (0.53) SLC6A4
SCHEMBL9721823 0.86 SLC6A4 (0.53) SLC6A4
SCHEMBL2006721 0.83 SLC6A4 (0.75) SLC6A4
SCHEMBL339642 0.83 SLC6A4 (0.75) SLC6A4
SCHEMBL7561729 0.83 SLC6A4 (0.53) SLC6A4
SCHEMBL2009409 0.83 SLC6A4 (0.75) SLC6A4
SCHEMBL6654388 0.83 SLC6A4 (0.58) SLC6A4
SCHEMBL7688733 0.82 SLC6A4 (0.73) SLC6A4
SCHEMBL30681653 0.81 SLC6A4 (0.69) SLC6A4

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-1706394-B1 PREPARATION OF ESCITALOPRAM REDDYS LAB INC DR (US) 2014-12-17 EP disclosed
US-20090018351-A1 PREPARATION OF ESCITALOPRAM DR. REDDY'S LABORATORIES, INC. (US) 2009-01-15 US disclosed
EP-1706394-A4 PREPARATION OF ESCITALOPRAM REDDYS LAB INC DR (US) 2008-10-22 EP disclosed
EP-1706394-A1 PREPARATION OF ESCITALOPRAM Dr. Reddy's Laboratories, Inc. (US) 2006-10-04 EP disclosed
WO-2005047274-A1 PREPARATION OF ESCITALOPRAM DR. REDDY'S LABORATORIES, INC. (US) 2005-05-26 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-20090018351-A1 PREPARATION OF ESCITALOPRAM HTR4, SLC6A4, HTR5A SLC6A4 2/4885

“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.