SCHEMBL4240445

SCHEMBL4240445

CSc1ccc(C2(C3CCN(C(=O)OC(C)(C)C)CC3)Oc3ccc(F)cc3O2)cc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.49
HRH3 Q9Y5N1 1/20 0.39
RORC P51449 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPT P10636 3/20 0.38
TP53 P04637 1/20 0.38
LMNA P02545 1/20 0.37
MMP13 P45452 1/20 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
SCHEMBL4241775 0.88 GPR119 (0.54) GPR119RORCSMN1; SMN2
SCHEMBL4244967 0.86 GPR119 (0.50) GPR119
SCHEMBL4240449 0.78 GPR119 (0.47) GPR119SMN1; SMN2MEN1KMT2AMMP13
SCHEMBL4240538 0.76 RORC (0.54) GPR119RORC
SCHEMBL4245263 0.74 GPR119 (0.44) GPR119RORCMEN1KMT2A
SCHEMBL4240557 0.74 GPR119 (0.55) GPR119
SCHEMBL4241246 0.74 GPR119 (0.53) GPR119RORC
SCHEMBL19409643 0.73 HRH3 (0.44) GPR119HRH3SMN1; SMN2MEN1KMT2A
SCHEMBL19409510 0.72 HRH3 (0.44) GPR119HRH3RORCSMN1; SMN2MEN1
SCHEMBL4777861 0.70 GPR119 (0.69) GPR119KMT2AMAPT

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 207/4885HRH3 703/4885RORC 105/4885

“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.