SCHEMBL7549752

SCHEMBL7549752

CN(CCN1CCCCC1)c1ccc(-c2nc3ccc(C(F)(F)F)cc3[nH]2)cc1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 1/20 0.69
DGAT1 O75907 8/20 0.56
KCNH2 Q12809 7/20 0.56
SOAT1 P35610 4/20 0.56
NPBWR1 P48145 8/20 0.55
ACHE P22303 3/20 0.49

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
SCHEMBL7553813 0.91 CCR2 (0.70) CCR2DGAT1KCNH2SOAT1NPBWR1
SCHEMBL7548595 0.87 CCR2 (0.73) CCR2ACHE
SCHEMBL7160131 0.86 CCR2 (0.74) CCR2ACHE
SCHEMBL7550045 0.85 CCR2 (0.79) CCR2ACHE
SCHEMBL7549628 0.84 CCR2 (0.71) CCR2DGAT1KCNH2ACHE
SCHEMBL7553543 0.83 CCR2 (0.79) CCR2ACHE
SCHEMBL7549399 0.83 CCR2 (0.79) CCR2ACHE
Hydrochloric Acid SCHEMBL7157093 0.82 CCR2 (0.69) CCR2ACHE
SCHEMBL7554508 0.82 CCR2 (0.72) CCR2ACHE
SCHEMBL7153825 0.82 CCR2 (1.00) CCR2ACHE

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-20020099054-A1 2-phenyl benzimidazole derivatives as MCP-1 antagonists WARNER-LAMBERT COMPANY (US) 2002-07-25 US claimed
US-6184235-B1 MONOCYTE CHEMOATTRACTANT PROTEIN-1 (MCP-1) ANTAGONIST FOR TREATMENT OF INFLAMMATORY DISEASES, ATHEROSCLEROSIS, RESTENOSIS, AUTOIMMUNE DISEASES, ORGAN TRANSPLANT REJECTION IN MAMMALS WARNER-LAMBERT COMPANY 2001-02-06 US claimed
EP-0927167-A1 2-PHENYL BENZIMIDAZOLE DERIVATIVES AS MCP-1 ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1999-07-07 EP claimed
WO-1998006703-A1 2-PHENYL BENZIMIDAZOLE DERIVATIVES AS MCP-1 ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1998-02-19 WO claimed

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-20020099054-A1 2-phenyl benzimidazole derivatives as MCP-1 antagonists CCR1, CCR2, CCR8 CCR2 2/4885DGAT1 3365/4885KCNH2 1111/4885

“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.