SCHEMBL4245253

SCHEMBL4245253

CC(C)(C)OC(=O)N1CCC(N(C2=CC=CCC2)C2=COC=CO2)CC1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 16/20 0.38
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 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
SCHEMBL621707 0.76 GPR119 (0.37) GPR119KDM4EMAPTTHRBMEN1
SCHEMBL3837667 0.64 MEN1 (0.61) GPR119KDM4EMEN1KMT2A
SCHEMBL25389387 0.62 MEN1 (0.68) GPR119MEN1KMT2A
SCHEMBL4711418 0.62 HPGD (0.55) GPR119MEN1KMT2A
SCHEMBL7421811 0.62 MEN1 (0.57) GPR119KDM4EMEN1KMT2A
SCHEMBL3012474 0.62 JAK2 (0.62) GPR119KDM4ETHRBMEN1KMT2A
SCHEMBL16565369 0.61 GPR119 (0.39) GPR119
SCHEMBL19633473 0.61 HPGD (0.54) GPR119
SCHEMBL803527 0.61 JAK2 (0.74) GPR119KDM4ETHRBMEN1KMT2A
SCHEMBL4773177 0.61 RECQL (0.58) GPR119KDM4EMAPTTHRB

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
US-7491735-B2 Chemokine receptor binding compounds GENZYME CORPORATION (US) 2009-02-17 US disclosed
EP-1708703-A4 CHEMOKINE RECEPTOR BINDING COMPOUNDS ANORMED INC (CA) 2008-04-09 EP disclosed
EP-1708703-A2 CHEMOKINE RECEPTOR BINDING COMPOUNDS ANORMED INC. (CA) 2006-10-11 EP disclosed
US-20050277670-A1 Chemokine receptor binding compounds ANORMED INC. 2005-12-15 US disclosed
WO-2005059107-A2 CHEMOKINE RECEPTOR BINDING COMPOUNDS ANORMED INC. (CA) 2005-06-30 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-20050277670-A1 Chemokine receptor binding compounds CCR5, CXCR3, CCL5 GPR119 207/4885KDM4E 4532/4885MAPT 3843/4885

“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.