SCHEMBL5090938

SCHEMBL5090938

CN(CCCn1c(N)nc2cccc(Cl)c21)C(=O)c1cccc(C(N)=O)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CXCR3 P49682 8/20 0.47
▸ PRMT5 O14744 1/20 0.42
▸ TLR8 Q9NR97 2/20 0.39
▸ MAP3K7 O43318 1/20 0.38
▸ NOD1 Q9Y239 1/20 0.36
▸ CDK1 P06493 1/20 0.36
▸ CDK4 P11802 1/20 0.36
▸ CDK2 P24941 1/20 0.36
▸ APOBEC3A P31941 1/20 0.36
▸ CASP7 P55210 1/20 0.36
▸ CASP6 P55212 1/20 0.36
▸ APOBEC3G Q9HC16 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ CXCR4 P61073 1/20 0.35
▸ BACE1 P56817 1/20 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
SCHEMBL5482661 0.90 CXCR3 (0.53) CXCR3PRMT5TLR8NOD1CXCR4
SCHEMBL5463737 0.83 PRMT5 (0.47) CXCR3PRMT5TLR8NOD1CDK1
SCHEMBL5473914 0.83 PRMT5 (0.49) CXCR3PRMT5TLR8NOD1CXCR4
SCHEMBL14373235 0.78 PRMT5 (0.43) CXCR3PRMT5TLR8NOD1CASP7
SCHEMBL5468452 0.78 TLR8 (0.45) CXCR3TLR8CXCR4
SCHEMBL14470744 0.75 CXCR3 (0.41) CXCR3TLR8CXCR4
SCHEMBL14373381 0.73 CXCR3 (0.84) CXCR3
SCHEMBL5453935 0.72 TLR8 (0.66) PRMT5TLR8NOD1CXCR4
SCHEMBL5453372 0.71 TLR8 (0.41) CXCR3TLR8NOD1CDK4
SCHEMBL5480685 0.70 TLR8 (0.48) CXCR3PRMT5TLR8CXCR4

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1983992-A2 2-IMINO-BENZIMIDAZOLES Abbott Laboratories (US) 2008-10-29 — — EP disclosed
US-20070232673-A1 2-Imino-benzimidazoles ABBOTT LABORATORIES 2007-10-04 — — US disclosed
US-20070232673-A1 2-Imino-benzimidazoles ABBOTT LABORATORIES 2007-10-04 — — US disclosed
US-20070232673-A1 2-Imino-benzimidazoles ABBOTT LABORATORIES 2007-10-04 — — US disclosed
WO-2007084728-A2 2-IMINO-BENZIMIDAZOLES ABBOTT LABORATORIES (US) 2007-07-26 — — WO disclosed
WO-2007084728-A2 2-IMINO-BENZIMIDAZOLES ABBOTT LABORATORIES (US) 2007-07-26 — — 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-20070232673-A1 2-Imino-benzimidazoles CYP2C19, UGT2B7, UGT2B17 CXCR3 4743/4885PRMT5 2145/4885TLR8 3837/4885

“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.

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