SCHEMBL21484600

SCHEMBL21484600

Cc1cc(/C=C(\C#N)C(=O)Nc2nc(-c3ccccc3)cs2)cc(C)c1O

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MRE11 P49959 4/20 0.58
LMNA P02545 2/20 0.48
PARP1 P09874 3/20 0.47
GSTO1 P78417 1/20 0.47
TAS2R14 Q9NYV8 1/20 0.46
MAPT P10636 2/20 0.46
ADORA3 P0DMS8 1/20 0.46
EGFR P00533 1/20 0.45
ERBB2 P04626 1/20 0.45
ALDH1A1 P00352 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL21484678 0.93 MRE11 (0.59) MRE11LMNAPARP1GSTO1MAPT
SCHEMBL21484858 0.92 MRE11 (0.50) MRE11LMNAPARP1GSTO1TAS2R14
SCHEMBL21484792 0.90 EGFR (0.53) MRE11LMNATAS2R14MAPTEGFR
SCHEMBL21484671 0.89 MRE11 (0.60) MRE11LMNAGSTO1MAPTEGFR
SCHEMBL21484775 0.88 MRE11 (0.51) MRE11LMNAPARP1GSTO1MAPT
SCHEMBL21484790 0.88 MRE11 (0.51) MRE11LMNAPARP1GSTO1MAPT
SCHEMBL21484813 0.88 CSNK2A1 (0.49) MRE11LMNAPARP1GSTO1TAS2R14
SCHEMBL21484797 0.87 MAPT (0.53) MRE11LMNAPARP1GSTO1MAPT
SCHEMBL21505934 0.87 ADORA3 (0.50) MRE11LMNAMAPTADORA3ALDH1A1
SCHEMBL21484735 0.87 LMNA (0.48) MRE11LMNAPARP1GSTO1TAS2R14

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
US-11453663-B2 Substituted propanamides as inhibitors of nucleases MASARYKOVA UNIVERZITA (CZ) 2022-09-27 US disclosed
US-20220073507-A1 SUBSTITUTED PROPANAMIDES AS INHIBITORS OF NUCLEASES MASARYKOVA UNIVERZITA (CZ) 2022-03-10 US disclosed
CN-112351983-A Substituted propionamides as inhibitors of nucleases 马萨里克大学 2021-02-09 CN disclosed
EP-3556756-B1 SUBSTITUTED PROPANAMIDES AS INHIBITORS OF NUCLEASES UNIV MASARYKOVA (CZ) 2020-10-07 EP disclosed
EP-3556756-B1 SUBSTITUTED PROPANAMIDES AS INHIBITORS OF NUCLEASES UNIV MASARYKOVA (CZ) 2020-10-07 EP disclosed
WO-2019201867-A1 SUBSTITUTED PROPANAMIDES AS INHIBITORS OF NUCLEASES MASARYKOVA UNIVERZITA (CZ) 2019-10-24 WO disclosed
WO-2019201867-A1 SUBSTITUTED PROPANAMIDES AS INHIBITORS OF NUCLEASES MASARYKOVA UNIVERZITA (CZ) 2019-10-24 WO disclosed
EP-3556756-A1 SUBSTITUTED PROPANAMIDES AS INHIBITORS OF NUCLEASES Masarykova univerzita (CZ) 2019-10-23 EP disclosed
EP-3556756-A1 SUBSTITUTED PROPANAMIDES AS INHIBITORS OF NUCLEASES Masarykova univerzita (CZ) 2019-10-23 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 (2 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-20220073507-A1 SUBSTITUTED PROPANAMIDES AS INHIBITORS OF NUCLEASES DNASE1, RNASEH1, FEN1 MRE11 86/4885LMNA 192/4885PARP1 17/4885
US-11453663-B2 Substituted propanamides as inhibitors of nucleases DNASE1, RNASEH1, FEN1 MRE11 86/4885LMNA 192/4885PARP1 17/4885

“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.