SCHEMBL4834675

SCHEMBL4834675

OCC1CCCCN1CC(O)COc1ccc(-c2nc3cc(Br)cnc3[nH]2)cc1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
RECQL P46063 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MEN1 O00255 4/20 0.39
CHEK2 O96017 6/20 0.38
TBK1 Q9UHD2 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
IKBKE Q14164 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 SCHEMBL4844114 0.93 KMT2A (0.41) KMT2AKDM4EALDH1A1RECQLNPSR1
SCHEMBL4843811 0.86 TBK1 (0.46) CHEK2TBK1IKBKE
SCHEMBL4839497 0.85 NPSR1 (0.54) KMT2AKDM4EALDH1A1NPSR1
SCHEMBL4839716 0.84 ATM (0.54) KMT2AKDM4EALDH1A1NPSR1
SCHEMBL4838783 0.84 KMT2A (0.43) KMT2AALDH1A1NPSR1MEN1
SCHEMBL4838868 0.84 CHEK2 (0.39) RECQLNPSR1CHEK2
SCHEMBL4838864 0.84 CHEK2 (0.39) RECQLNPSR1CHEK2
SCHEMBL4837805 0.84 KDM4E (0.40) KMT2AKDM4EALDH1A1RECQLNPSR1
SCHEMBL4844690 0.82 MEN1 (0.58) KMT2AKDM4ENPSR1MEN1
SCHEMBL4843135 0.82 KMT2A (0.50) KMT2AALDH1A1NPSR1MEN1

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 5 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
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

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 KMT2A 2697/4885KDM4E 2903/4885ALDH1A1 1489/4885

“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.