SCHEMBL1990719

SCHEMBL1990719

CC(C)(C)C(=O)N[C@H]1CCNC1=O

nearest known ligand 0.79

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 16/20 0.79
CCR1 P32246 1/20 0.50
CCR5 P51681 1/20 0.50
CXCR4 P61073 1/20 0.50
RAB9A P51151 2/20 0.42
NPC1 O15118 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
SCHEMBL12206759 1.00 CCR2 (0.79) CCR2CCR1CCR5CXCR4RAB9A
SCHEMBL12207219 1.00 CCR2 (0.79) CCR2CCR1CCR5CXCR4RAB9A
SCHEMBL196068 0.90 CCR2 (0.91) CCR2CCR1CCR5CXCR4RAB9A
SCHEMBL12233199 0.90 CCR2 (0.91) CCR2CCR1CCR5CXCR4RAB9A
SCHEMBL195030 0.90 CCR2 (0.91) CCR2CCR1CCR5CXCR4RAB9A
SCHEMBL13605161 0.88 CCR2 (1.00) CCR2CCR1CCR5CXCR4RAB9A
SCHEMBL12849253 0.88 CCR2 (1.00) CCR2CCR1CCR5CXCR4RAB9A
SCHEMBL16104180 0.83 CCR2 (0.81) CCR2CCR1CCR5CXCR4RAB9A
SCHEMBL6618485 0.82 CCR2 (0.55) CCR2CCR1CCR5CXCR4RAB9A
SCHEMBL6618482 0.82 CCR2 (0.55) CCR2CCR1CCR5CXCR4RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110150873-A1 ANTI-INFLAMMATORY COMPOSITIONS AND COMBINATIONS CAMBRIDGE ENTERPRISE LIMITED (GB) 2011-06-23 US claimed
US-20130060013-A1 Compounds useful for treating neurodegenerative disorders SATORI PHARMACEUTICALS, INC. (US) 2013-03-07 US disclosed
US-20110251379-A1 COMPOUNDS USEFUL FOR TREATING NEURODEGENERATIVE DISORDERS SATORI PHARMACEUTICALS, INC. (US) 2011-10-13 US disclosed
US-20110150873-A1 ANTI-INFLAMMATORY COMPOSITIONS AND COMBINATIONS CAMBRIDGE ENTERPRISE LIMITED (GB) 2011-06-23 US 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 (3 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-20130060013-A1 Compounds useful for treating neurodegenerative disorders SNCA, HTT, CLN6 CCR2 4494/4885CCR1 4474/4885CCR5 4410/4885
US-20110150873-A1 ANTI-INFLAMMATORY COMPOSITIONS AND COMBINATIONS CCL2, CCL5, CXCL10 CCR2 5/4885CCR1 11/4885CCR5 13/4885
US-20110251379-A1 COMPOUNDS USEFUL FOR TREATING NEURODEGENERATIVE DISORDERS CLN6, NLN, ACHE CCR2 4418/4885CCR1 4568/4885CCR5 4213/4885

“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.