SCHEMBL4840783

SCHEMBL4840783

Clc1ccc(CNCCOc2ccc(-c3nc4cc(Br)cnc4[nH]3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 4/20 0.44
ACHE P22303 6/20 0.41
HDAC6 Q9UBN7 1/20 0.40
HRH4 Q9H3N8 1/20 0.38
PPARG P37231 1/20 0.37
BCHE P06276 1/20 0.37
DRD2 P14416 2/20 0.37
DRD3 P35462 2/20 0.37
CHEK2 O96017 1/20 0.37
LMNA P02545 1/20 0.36
KDR P35968 1/20 0.36

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
Trifluoroacetic Acid SCHEMBL4842215 0.92 HDAC6 (0.41) DRD4ACHEHDAC6DRD2DRD3
SCHEMBL4901128 0.91 DRD4 (0.46) DRD4ACHEHRH4BCHEDRD2
SCHEMBL4846224 0.90 SLC2A1 (0.44) HDAC6PPARGCHEK2
SCHEMBL4839100 0.90 PPARG (0.49) DRD4HDAC6PPARGDRD2DRD3
SCHEMBL5256661 0.89 ADRA1D (0.41) DRD4ACHEHRH4PPARGDRD2
SCHEMBL4844225 0.89 HDAC6 (0.38) DRD4ACHEHDAC6PPARG
SCHEMBL4838750 0.84 HRH4 (0.44) DRD4HRH4PPARG
SCHEMBL6221322 0.84 BCHE (0.43) DRD4HDAC6BCHE
Trifluoroacetic Acid SCHEMBL4835096 0.84 TAAR1 (0.48) DRD4ACHEHDAC6DRD2DRD3
SCHEMBL4841328 0.84 KMT2A (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539759-B1 NOVEL IMIDAZOPYRIDINES AND THEIR USE ASTRAZENECA AB (SE) 2007-08-15 EP claimed
US-20050261333-A1 Use of and some novel imidazopyridines ASTRAZENECA A B (SE) 2005-11-24 US claimed
EP-1539759-A1 USE OF AND SOME NOVEL IMIDAZOPYRIDINES AstraZeneca AB (SE) 2005-06-15 EP claimed
WO-2004016611-A1 USE OF AND SOME NOVEL IMIDAZOPYRIDINES ASTRAZENECA AB (SE) 2004-02-26 WO claimed
US-7410966-B2 Use of and some novel imidazopyridines ASTRAZENECA AB (SE) 2008-08-12 US disclosed
EP-1539759-B1 NOVEL IMIDAZOPYRIDINES AND THEIR USE ASTRAZENECA AB (SE) 2007-08-15 EP disclosed
US-20050261333-A1 Use of and some novel imidazopyridines ASTRAZENECA A B (SE) 2005-11-24 US disclosed
EP-1539759-A1 USE OF AND SOME NOVEL IMIDAZOPYRIDINES AstraZeneca AB (SE) 2005-06-15 EP disclosed
WO-2004016611-A1 USE OF AND SOME NOVEL IMIDAZOPYRIDINES ASTRAZENECA AB (SE) 2004-02-26 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-20050261333-A1 Use of and some novel imidazopyridines ITK, CSNK1A1, RPS6KA1 DRD4 3813/4885ACHE 1390/4885HDAC6 981/4885

“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.