SCHEMBL21495084

SCHEMBL21495084

N#CCC(=O)Nc1nc(-c2cccc(N3CCOCC3)n2)cs1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.53
KDM4E B2RXH2 4/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
KMT2A Q03164 3/20 0.53
ALDH1A1 P00352 3/20 0.53
RAB9A P51151 2/20 0.53
MEN1 O00255 2/20 0.53
NPC1 O15118 1/20 0.53
ABL1 P00519 1/20 0.49
POLB P06746 1/20 0.45
JAK1 P23458 4/20 0.45
JAK3 P52333 4/20 0.45
JAK2 O60674 3/20 0.45
NCOA1 Q15788 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 3/20 0.42
USP2 O75604 2/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL21495029 0.86 MAPT (0.59) MAPTKDM4ESMN1; SMN2KMT2AALDH1A1
SCHEMBL21484812 0.83 KMT2A (0.63) MAPTKDM4ESMN1; SMN2KMT2AALDH1A1
SCHEMBL21484645 0.78 ABL1 (0.57) MAPTKDM4ESMN1; SMN2KMT2AALDH1A1
SCHEMBL28519673 0.78 LMNA (0.44) MAPTKDM4ESMN1; SMN2KMT2AALDH1A1
SCHEMBL21484634 0.75 MRE11 (0.58) MAPTKDM4ESMN1; SMN2KMT2AALDH1A1
SCHEMBL21484682 0.74 ALDH1A1 (0.64) MAPTKDM4ESMN1; SMN2KMT2AALDH1A1
SCHEMBL21484761 0.74 ABL1 (0.57) MAPTKDM4ESMN1; SMN2KMT2AALDH1A1
SCHEMBL21484713 0.73 ABL1 (0.68) MAPTKDM4ESMN1; SMN2KMT2AALDH1A1
SCHEMBL21495017 0.71 AR (0.50) MAPTSMN1; SMN2KMT2ARAB9AMEN1
SCHEMBL21484850 0.71 ABL1 (0.69) MAPTKDM4ESMN1; SMN2KMT2AALDH1A1

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
US-11584742-B2 Substituted aminothiazoles as inhibitors of nucleases MASARYKOVA UNIVERZITA (CZ) 2023-02-21 US disclosed
US-20220002282-A1 SUBSTITUTED AMINOTHIAZOLES AS INHIBITORS OF NUCLEASES MASARYKOVA UNIVERZITA (CZ) 2022-01-06 US disclosed
CN-112313229-A Substituted aminothiazoles as inhibitors of nucleases 马萨里克大学 2021-02-02 CN disclosed
WO-2019201865-A1 SUBSTITUTED AMINOTHIAZOLES AS INHIBITORS OF NUCLEASES MASARYKOVA UNIVERZITA (CZ) 2019-10-24 WO disclosed
WO-2019201865-A1 SUBSTITUTED AMINOTHIAZOLES AS INHIBITORS OF NUCLEASES MASARYKOVA UNIVERZITA (CZ) 2019-10-24 WO 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-11584742-B2 Substituted aminothiazoles as inhibitors of nucleases RNASEH1, DNASE1, FEN1 MAPT 706/4885KDM4E 1848/4885SMN1; SMN2 104/4885
US-20220002282-A1 SUBSTITUTED AMINOTHIAZOLES AS INHIBITORS OF NUCLEASES RNASEH1, DNASE1, FEN1 MAPT 706/4885KDM4E 1848/4885SMN1; SMN2 104/4885

“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.