SCHEMBL7546613

SCHEMBL7546613

CN(CCN1CCCCC1)c1ccccc1-c1nc2cc(Cl)c(Cl)cc2[nH]1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 1/20 0.68
HRH3 Q9Y5N1 3/20 0.45
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
ACHE P22303 4/20 0.40
SIGMAR1 Q99720 8/20 0.39
TP53 P04637 2/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2D6 P10635 2/20 0.39
TSHR P16473 2/20 0.39
GRIN2D O15399 1/20 0.39
GRIN3B O60391 1/20 0.39
CYP3A4 P08684 1/20 0.39
GRIN1 Q05586 1/20 0.39
GRIN2A Q12879 1/20 0.39
GRIN2B Q13224 1/20 0.39
GRIN2C Q14957 1/20 0.39
GRIN3A Q8TCU5 1/20 0.39

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
SCHEMBL7554532 0.89 CCR2 (0.54) CCR2HRH3ACHESIGMAR1KDM4E
SCHEMBL7553615 0.89 CCR2 (0.54) CCR2HRH3MEN1NPC1RAB9A
SCHEMBL7549627 0.86 HRH3 (0.52) CCR2HRH3MEN1NPC1RAB9A
SCHEMBL7549975 0.85 CCR2 (0.55) CCR2HRH3MEN1NPC1RAB9A
SCHEMBL7548839 0.82 CCR2 (0.81) CCR2HRH3ACHESIGMAR1TP53
SCHEMBL7552060 0.82 HRH3 (0.47) CCR2HRH3MEN1RAB9AKMT2A
SCHEMBL7553497 0.82 HRH3 (0.47) CCR2HRH3NPC1RAB9AACHE
SCHEMBL7153825 0.81 CCR2 (1.00) CCR2ACHESIGMAR1TP53CYP1A2
SCHEMBL7546719 0.78 HRH3 (0.48) HRH3
SCHEMBL7550676 0.78 HRH3 (0.54) CCR2HRH3NPC1ACHESIGMAR1

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 1 patent. 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 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-20020099054-A1 2-phenyl benzimidazole derivatives as MCP-1 antagonists CCR1, CCR2, CCR8 CCR2 2/4885HRH3 165/4885MEN1 4732/4885

“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.