SCHEMBL7546612

SCHEMBL7546612

Clc1cc2nc(-c3ccccc3CNCCN3CCCCC3)[nH]c2cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 1/20 0.51
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
KMT2A Q03164 1/20 0.45
PDCD1 Q15116 2/20 0.41
CD274 Q9NZQ7 2/20 0.41
DPP7 Q9UHL4 1/20 0.41
APP P05067 2/20 0.41
ACHE P22303 3/20 0.40
PRCP P42785 1/20 0.40
SIGMAR1 Q99720 2/20 0.40
ESR1 P03372 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
RHEB Q15382 1/20 0.39
ACP1 P24666 1/20 0.38
CYP1A2 P05177 1/20 0.38

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
SCHEMBL7554529 0.90 HRH4 (0.44) CCR2PDCD1CD274DPP7APP
SCHEMBL7553609 0.90 ACHE (0.52) CCR2MEN1NPC1RAB9AKMT2A
SCHEMBL7549624 0.87 ACHE (0.51) MEN1NPC1RAB9AKMT2ADPP7
SCHEMBL7553494 0.82 PDE5A (0.45) DPP7APPACHECYP1A2CYP2D6
SCHEMBL7552057 0.82 DPP7 (0.41) DPP7APPACHEKDM4EALDH1A1
SCHEMBL7553785 0.82 CCR2 (0.62) CCR2DPP7ACHESIGMAR1RHEB
SCHEMBL7548837 0.82 CCR2 (0.54) CCR2DPP7ACHESIGMAR1RHEB
SCHEMBL7550672 0.80 DPP7 (0.42) PDCD1CD274DPP7APPACHE
SCHEMBL7546715 0.79 PDE5A (0.47) DPP7
SCHEMBL7546613 0.76 CCR2 (0.68) CCR2MEN1NPC1RAB9AKMT2A

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 2/4885MEN1 4732/4885NPC1 385/4885

“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.