SCHEMBL3762934

SCHEMBL3762934

Cc1cccc(CN(C(=O)CC2CCOCC2)C2CCN(C(=O)OC(C)(C)C)CC2)c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.47
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TACR1 P25103 2/20 0.42
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
MAPT P10636 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
SLC2A1 P11166 1/20 0.40
TGFBR1 P36897 1/20 0.40
KDM1A O60341 1/20 0.40

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
SCHEMBL3763037 0.91 GPR119 (0.46) GPR119MEN1KMT2AJAK2JAK1
SCHEMBL4203069 0.80 MEN1 (0.50) GPR119MEN1KMT2ATACR1SLC2A1
SCHEMBL3764740 0.80 JAK2 (0.52) GPR119MEN1KMT2AJAK2JAK1
SCHEMBL3763038 0.77 GPR119 (0.42) GPR119MEN1KMT2ATACR1JAK2
SCHEMBL25487730 0.76 GPR119 (0.53) GPR119MEN1KMT2AJAK2JAK1
SCHEMBL4313481 0.73 MEN1 (0.52) GPR119MEN1KMT2AJAK2JAK1
SCHEMBL4302417 0.72 MEN1 (0.51) GPR119MEN1KMT2AKDM1A
SCHEMBL4904281 0.72 YAP1 (0.50) GPR119JAK2JAK1
SCHEMBL618193 0.72 JAK2 (0.59) GPR119MEN1KMT2AJAK2JAK1
SCHEMBL3765125 0.71 JAK2 (0.51) GPR119MEN1KMT2AJAK2JAK1

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 207/4885MEN1 4855/4885KMT2A 4728/4885
US-20090099205-A1 Chemokine receptor binding compounds CCR5, CXCR3, CCL5 GPR119 207/4885MEN1 4855/4885KMT2A 4728/4885

“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.