SCHEMBL6104753

SCHEMBL6104753

CN1CCCc2cc(Br)cc(C=CC(=O)O)c21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EIF2AK2 P19525 1/20 0.37
CSNK2A2 P19784 1/20 0.37
CSNK2B P67870 1/20 0.37
CSNK2A1 P68400 1/20 0.37
NPSR1 Q6W5P4 2/20 0.35
ALOX5 P09917 4/20 0.34
LMNA P02545 1/20 0.34
PMP22 Q01453 1/20 0.34
GFER P55789 1/20 0.34
ALDH1A1 P00352 3/20 0.33
POLB P06746 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
GAA P10253 2/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CASP6 P55212 1/20 0.32
CAMK2A Q9UQM7 1/20 0.32

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
SCHEMBL6104750 1.00 EIF2AK2 (0.37) EIF2AK2CSNK2A2CSNK2BCSNK2A1NPSR1
SCHEMBL6103237 0.82 NPSR1 (0.38) NPSR1LMNAALDH1A1POLBMEN1
SCHEMBL6103232 0.82 NPSR1 (0.38) NPSR1LMNAALDH1A1POLBMEN1
SCHEMBL6104087 0.80 ALDH1A1 (0.44) NPSR1ALDH1A1POLBMEN1KMT2A
SCHEMBL22004779 0.69 NOTUM (0.38) NPSR1LMNAALDH1A1MEN1KMT2A
SCHEMBL22939176 0.69 TTR (0.42) ALDH1A1POLBMEN1KMT2AGAA
SCHEMBL23260254 0.67 KMT2A (0.42) ALOX5GFERALDH1A1POLBKMT2A
SCHEMBL9675977 0.64 ALDH1A1 (0.49) ALDH1A1POLBMEN1KMT2AGAA
SCHEMBL6103247 0.64 SMN1; SMN2 (0.41) EIF2AK2CSNK2A2CSNK2BCSNK2A1NPSR1
SCHEMBL6103241 0.64 SMN1; SMN2 (0.41) EIF2AK2CSNK2A2CSNK2BCSNK2A1NPSR1

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
US-20060160864-A1 Acrylamide derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-07-20 US disclosed
EP-1593673-A1 ACRYLAMIDE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Pharmaceutical Company Limited (JP) 2005-11-09 EP 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-20060160864-A1 Acrylamide derivative, process for producing the same, and use CCR5, MSR1, CCR2 EIF2AK2 479/4885CSNK2A2 2063/4885CSNK2B 2161/4885

“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.