SCHEMBL7548236

SCHEMBL7548236

CN(C)CCN(CCN(C)C)c1cccc(-c2nc3ccccc3[nH]2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.55
KDM4E B2RXH2 13/20 0.55
SMN1; SMN2 Q16637 11/20 0.55
NPC1 O15118 10/20 0.55
RAB9A P51151 10/20 0.55
ALDH1A1 P00352 8/20 0.55
HPGD P15428 4/20 0.55
HSD17B10 Q99714 3/20 0.55
TP53 P04637 2/20 0.55
GAA P10253 1/20 0.53
PIM1 P11309 1/20 0.50
PIM3 Q86V86 1/20 0.50
AURKB Q96GD4 1/20 0.50
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
POLB P06746 3/20 0.49
MAPT P10636 4/20 0.48
PKM P14618 3/20 0.48
NFKB1 P19838 1/20 0.48
NFKB2 Q00653 1/20 0.48

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
SCHEMBL7554475 0.87 SMN1; SMN2 (0.52) ACHEKDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL7549644 0.86 ACHE (0.64) ACHEKDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL7546743 0.85 AURKA (0.56) ACHEKDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL7155484 0.85 AURKA (0.44) ACHEKDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL7547117 0.85 ACHE (0.47) ACHEKDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL7550061 0.85 ACHE (0.58) ACHEKDM4ENPC1ALDH1A1HPGD
SCHEMBL7156630 0.84 CCR2 (0.49) ACHEKDM4ENPC1RAB9AALDH1A1
SCHEMBL7155763 0.83 AURKA (0.48) ACHEKDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL7155458 0.81 AURKA (0.73) PIM1PIM3AURKBAURKAPKN2
SCHEMBL7155394 0.78 CHEK2 (0.40) ACHEKDM4ESMN1; SMN2NPC1RAB9A

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 3 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 disclosed
EP-0927167-A1 2-PHENYL BENZIMIDAZOLE DERIVATIVES AS MCP-1 ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1999-07-07 EP disclosed
WO-1998006703-A1 2-PHENYL BENZIMIDAZOLE DERIVATIVES AS MCP-1 ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1998-02-19 WO 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 ACHE 4652/4885KDM4E 2846/4885SMN1; SMN2 3655/4885

“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.