SCHEMBL7552060

SCHEMBL7552060

CN(CCN1CCCCC1)c1ccccc1-c1nc2cnccc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.47
CCR2 P41597 1/20 0.46
ACHE P22303 2/20 0.40
PDE5A O76074 3/20 0.38
KDM4E B2RXH2 4/20 0.37
USP2 O75604 3/20 0.36
ALDH1A1 P00352 3/20 0.36
HPGD P15428 3/20 0.36
HSD17B10 Q99714 3/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HTT P42858 1/20 0.36
MEN1 O00255 2/20 0.35
MAPT P10636 2/20 0.35
CASP1 P29466 2/20 0.35
BRCA1 P38398 2/20 0.35
RAB9A P51151 2/20 0.35
CASP7 P55210 2/20 0.35
KMT2A Q03164 2/20 0.35

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
SCHEMBL7553497 0.92 HRH3 (0.47) HRH3CCR2ACHEPDE5AKDM4E
SCHEMBL7549627 0.88 HRH3 (0.52) HRH3CCR2ACHEKDM4EUSP2
SCHEMBL7157044 0.85 HRH3 (0.39) HRH3CCR2ACHEPDE5AKDM4E
SCHEMBL7157333 0.83 HRH3 (0.47) HRH3CCR2ACHEHSD17B10MEN1
SCHEMBL7554532 0.83 CCR2 (0.54) HRH3CCR2ACHEKDM4ESIGMAR1
SCHEMBL7550676 0.82 HRH3 (0.54) HRH3CCR2ACHEKDM4EUSP2
SCHEMBL7546613 0.82 CCR2 (0.68) HRH3CCR2ACHEKDM4EALDH1A1
SCHEMBL7546028 0.81 CCR2 (0.68) HRH3CCR2ACHEKDM4EALDH1A1
SCHEMBL7554509 0.81 CCR2 (0.56) HRH3CCR2ACHEKDM4EALDH1A1
SCHEMBL7156999 0.81 HRH3 (0.44) HRH3CCR2ACHEPDE5ASIGMAR1

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 HRH3 165/4885CCR2 2/4885ACHE 4652/4885

“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.