SCHEMBL5789350

SCHEMBL5789350

Cc1cccc(-c2nc3ccccn3c2-c2ccnc(Br)c2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 4/20 0.44
CDK4 P11802 3/20 0.44
MAPT P10636 3/20 0.41
KDM4E B2RXH2 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
TGFBR1 P36897 6/20 0.41
KDR P35968 1/20 0.41
GAA P10253 3/20 0.40
CCNE1 P24864 2/20 0.40
HTT P42858 2/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 2/20 0.40
POLB P06746 1/20 0.40
NCOA1 Q15788 1/20 0.40
NCOA3 Q9Y6Q9 1/20 0.40

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
SCHEMBL5787113 0.88 GAA (0.41) MAPTKDM4ETGFBR1KDRGAA
SCHEMBL5791338 0.86 IGF1R (0.38) CDK2CDK4MAPTKDM4ENPC1
SCHEMBL5787148 0.86 PTGS2 (0.49) CDK2CDK4MAPTKDM4ENPC1
SCHEMBL5788274 0.84 PIK3CD (0.45) MAPTKDM4ETGFBR1KDRGAA
SCHEMBL5792126 0.83 GAA (0.42) MAPTKDM4ENPC1RAB9ATGFBR1
SCHEMBL4863474 0.83 CDK4 (0.43) CDK2CDK4MAPTKDM4ENPC1
SCHEMBL5789474 0.83 CDK4 (0.46) CDK2CDK4MAPTTGFBR1KDR
SCHEMBL5792573 0.83 TGFBR1 (0.45) CDK2CDK4TGFBR1KDRMAPK14
SCHEMBL4878226 0.82 TGFBR1 (0.59) TGFBR1MAPK14
SCHEMBL5789426 0.81 NPC1 (0.47) KDM4ENPC1RAB9ATGFBR1KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1543003-B1 IMIDAZO¬1,2-A|PYRIDINES SMITHKLINE BEECHAM CORP (US) 2006-05-17 EP disclosed
US-20050234029-A1 Compounds DODIC NERINA 2005-10-20 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-20050234029-A1 Compounds SMAD3, SMAD2, ACVR1 CDK2 47/4885CDK4 174/4885MAPT 1376/4885

“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.