SCHEMBL6103247

SCHEMBL6103247

O=C(O)C=Cc1cc(Br)ccc1N1CCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
EIF2AK2 P19525 1/20 0.41
CSNK2A2 P19784 1/20 0.41
CSNK2B P67870 1/20 0.41
CSNK2A1 P68400 1/20 0.41
KDM4E B2RXH2 3/20 0.39
GAA P10253 2/20 0.39
POLB P06746 2/20 0.39
HSD17B10 Q99714 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
LMNA P02545 3/20 0.39
GFER P55789 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
PAX8 Q06710 1/20 0.39
PMP22 Q01453 1/20 0.39

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
SCHEMBL6103241 1.00 SMN1; SMN2 (0.41) SMN1; SMN2EIF2AK2CSNK2A2CSNK2BCSNK2A1
SCHEMBL6103613 0.99 GAA (0.41) SMN1; SMN2EIF2AK2CSNK2A2CSNK2BCSNK2A1
SCHEMBL6104091 0.99 GAA (0.41) SMN1; SMN2EIF2AK2CSNK2A2CSNK2BCSNK2A1
SCHEMBL6103607 0.99 GAA (0.41) SMN1; SMN2EIF2AK2CSNK2A2CSNK2BCSNK2A1
SCHEMBL6105716 0.99 GAA (0.41) SMN1; SMN2EIF2AK2CSNK2A2CSNK2BCSNK2A1
SCHEMBL6104095 0.99 GAA (0.41) SMN1; SMN2EIF2AK2CSNK2A2CSNK2BCSNK2A1
SCHEMBL6105724 0.99 GAA (0.41) SMN1; SMN2EIF2AK2CSNK2A2CSNK2BCSNK2A1
SCHEMBL29952402 0.88 LMNA (0.41) SMN1; SMN2EIF2AK2CSNK2A2CSNK2BCSNK2A1
SCHEMBL6106291 0.87 BACE1 (0.43) SMN1; SMN2ALDH1A1NPSR1PTPN1MAPT
SCHEMBL6106286 0.87 BACE1 (0.43) SMN1; SMN2ALDH1A1NPSR1PTPN1MAPT

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 SMN1; SMN2 2871/4885EIF2AK2 479/4885CSNK2A2 2063/4885

“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.