SCHEMBL757352

SCHEMBL757352

COC(=O)CCCSCCN1C(=O)CCC[C@@H]1CO

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 10/20 0.43
PTGER3 P43115 1/20 0.39
PTGER2 P43116 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.33
TSHR P16473 1/20 0.33
EPHX2 P34913 1/20 0.32
BRD4 O60885 1/20 0.32

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
SCHEMBL757353 1.00 PTGER4 (0.43) PTGER4PTGER3PTGER2SMN1; SMN2TSHR
SCHEMBL5215820 0.94 PTGER4 (0.42) PTGER4PTGER3PTGER2
SCHEMBL4381445 0.86 PTGER4 (0.40) PTGER4PTGER3PTGER2SMN1; SMN2EPHX2
SCHEMBL4381437 0.86 PTGER4 (0.40) PTGER4PTGER3PTGER2SMN1; SMN2EPHX2
SCHEMBL756673 0.83 PTGER4 (0.51) PTGER4PTGER3PTGER2
SCHEMBL756672 0.83 PTGER4 (0.51) PTGER4PTGER3PTGER2
SCHEMBL14463696 0.81 PTGER4 (0.39) PTGER4PTGER3PTGER2
SCHEMBL5502471 0.80 PTGER4 (0.46) PTGER4
SCHEMBL755589 0.80 PTGER4 (0.41) PTGER4PTGER3PTGER2
SCHEMBL755588 0.80 PTGER4 (0.41) PTGER4PTGER3PTGER2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1761495-B1 PIPERIDINYL PROSTAGLANDIN ANALOGS AS OCULAR HYPOTENSIVE AGENTS ALLERGAN INC (US) 2012-03-21 EP disclosed
US-7435746-B2 5-thiopiperdinyl prostaglandin E analogs ALLERGAN, INC. (US) 2008-10-14 US disclosed
US-7435746-B2 5-thiopiperdinyl prostaglandin E analogs ALLERGAN, INC. (US) 2008-10-14 US disclosed
EP-1761495-A2 PIPERIDINYL PROSTAGLANDIN ANALOGS AS OCULAR HYPOTENSIVE AGENTS Allergan Inc. (US) 2007-03-14 EP disclosed
US-20060281713-A1 5-Thiopiperdinyl prostaglandin e analogs OLD DAVID W 2006-12-14 US disclosed
WO-2005121086-A2 PIPERIDINYL PROSTAGLANDIN ANALOGS AS OCULAR HYPOTENSIVE AGENTS ALLERGAN, INC. (US) 2005-12-22 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-20060281713-A1 5-Thiopiperdinyl prostaglandin e analogs PTGES, PTGES2, ALOX5 PTGER4 11/4885PTGER3 16/4885PTGER2 10/4885

“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.