SCHEMBL3757151

SCHEMBL3757151

CONC(=O)N(Cc1ccsc1)C1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.50
CCR5 P51681 6/20 0.49
KCNH2 Q12809 4/20 0.49
TP53 P04637 2/20 0.42
LMNA P02545 1/20 0.42
HTR2A P28223 1/20 0.41

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
SCHEMBL4416636 0.79 CCR5 (0.52) CCR5KCNH2
SCHEMBL3749999 0.79 CCR5 (0.50) CCR5KCNH2
SCHEMBL3749922 0.78 CCR5 (0.60) CCR5KCNH2
SCHEMBL3764144 0.77 GPR119 (0.47) GPR119TP53LMNA
SCHEMBL4236458 0.77 GPR119 (0.51) GPR119CCR5TP53LMNA
SCHEMBL4552231 0.76 CCR5 (0.48) CCR5KCNH2
SCHEMBL3758464 0.76 GPR119 (0.46) GPR119TP53LMNA
SCHEMBL3758467 0.75 GPR119 (0.45) GPR119TP53LMNA
SCHEMBL4500201 0.75 GPR119 (0.52) GPR119TP53LMNA
SCHEMBL4240462 0.75 GPR119 (0.54) GPR119CCR5

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
US-20100298366-A1 CHEMOKINE RECEPTOR BINDING COMPOUNDS GENZYME CORPORATION (US) 2010-11-25 US disclosed
US-7790747-B2 Chemokine receptor binding compounds GENZYME CORPORATION (US) 2010-09-07 US disclosed
EP-1942890-A4 CHEMOKINE RECEPTOR BINDING COMPOUNDS GENZYME CORP (US) 2009-08-26 EP disclosed
US-20090099205-A1 Chemokine receptor binding compounds GENZYME CORPORATION 2009-04-16 US disclosed
EP-1942890-A2 CHEMOKINE RECEPTOR BINDING COMPOUNDS ANORMED INC. (CA) 2008-07-16 EP disclosed
WO-2006138350-A2 CHEMOKINE RECEPTOR BINDING COMPOUNDS ANORMED INC. (CA) 2006-12-28 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 (2 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-20100298366-A1 CHEMOKINE RECEPTOR BINDING COMPOUNDS CCR5, CXCR3, CCL5 GPR119 207/4885CCR5 1/4885KCNH2 4679/4885
US-20090099205-A1 Chemokine receptor binding compounds CCR5, CXCR3, CCL5 GPR119 207/4885CCR5 1/4885KCNH2 4679/4885

“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.