SCHEMBL21484846

SCHEMBL21484846

Cc1sc(NC(=O)CC#N)nc1-c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.67
HSD17B10 Q99714 3/20 0.67
MAPK1 P28482 1/20 0.67
ALOX5 P09917 1/20 0.62
CYP1A2 P05177 1/20 0.62
CYP2C9 P11712 1/20 0.62
CYP2C19 P33261 1/20 0.62
GSTO1 P78417 1/20 0.60
XIAP P98170 1/20 0.58
MAPT P10636 6/20 0.57
RORC P51449 1/20 0.57
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
RAB9A P51151 3/20 0.56
LMNA P02545 2/20 0.56
NPSR1 Q6W5P4 2/20 0.56
PKM P14618 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.55
NPC1 O15118 2/20 0.55
HPGD P15428 2/20 0.55

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
SCHEMBL21484729 0.86 PTGS2 (0.58) ALDH1A1HSD17B10MAPK1XIAPMAPT
SCHEMBL21484898 0.85 ALDH1A1 (0.48) ALDH1A1HSD17B10MAPK1ALOX5CYP1A2
SCHEMBL21505993 0.85 ALDH1A1 (0.48) ALDH1A1HSD17B10MAPK1ALOX5CYP1A2
SCHEMBL21484782 0.85 ALDH1A1 (0.49) ALDH1A1HSD17B10MAPK1ALOX5CYP1A2
SCHEMBL21484599 0.84 SMN1; SMN2 (0.58) ALDH1A1HSD17B10MAPK1XIAPMAPT
SCHEMBL10810440 0.81 ALOX5 (0.76) ALDH1A1HSD17B10MAPK1ALOX5CYP1A2
SCHEMBL15086878 0.79 ALOX5 (0.74) ALDH1A1HSD17B10MAPK1ALOX5CYP1A2
SCHEMBL18215318 0.78 ALOX5 (0.72) ALDH1A1HSD17B10MAPK1ALOX5CYP1A2
SCHEMBL11476839 0.78 ALOX5 (0.72) ALDH1A1HSD17B10MAPK1ALOX5CYP1A2
SCHEMBL21484639 0.78 MRE11 (0.59) ALDH1A1HSD17B10MAPK1RORCMEN1

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 11 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-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
US-20220002282-A1 SUBSTITUTED AMINOTHIAZOLES AS INHIBITORS OF NUCLEASES MASARYKOVA UNIVERZITA (CZ) 2022-01-06 US disclosed
EP-3556755-B1 SUBSTITUTED AMINOTHIAZOLES AS INHIBITORS OF NUCLEASES UNIV MASARYKOVA (CZ) 2021-11-17 EP disclosed
EP-3556755-B1 SUBSTITUTED AMINOTHIAZOLES AS INHIBITORS OF NUCLEASES UNIV MASARYKOVA (CZ) 2021-11-17 EP 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
EP-3556755-A1 SUBSTITUTED AMINOTHIAZOLES AS INHIBITORS OF NUCLEASES Masarykova univerzita (CZ) 2019-10-23 EP disclosed
EP-3556755-A1 SUBSTITUTED AMINOTHIAZOLES 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-11584742-B2 Substituted aminothiazoles as inhibitors of nucleases RNASEH1, DNASE1, FEN1 ALDH1A1 2267/4885HSD17B10 2790/4885MAPK1 3578/4885
US-20220002282-A1 SUBSTITUTED AMINOTHIAZOLES AS INHIBITORS OF NUCLEASES RNASEH1, DNASE1, FEN1 ALDH1A1 2267/4885HSD17B10 2790/4885MAPK1 3578/4885

“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.