SCHEMBL17675338

SCHEMBL17675338

NC(=O)C(c1ccncc1)n1cccn1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.34
ELANE P08246 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
PDGFRA P16234 1/20 0.33
MAPK1 P28482 1/20 0.33
MAPKAPK2 P49137 1/20 0.33
RPS6KA1 Q15418 1/20 0.33
AURKB Q96GD4 1/20 0.33
CSNK1G1 Q9HCP0 1/20 0.33
SLC6A2 P23975 2/20 0.32
SLC6A4 P31645 2/20 0.32
SLC6A3 Q01959 2/20 0.32
MAP2K3 P46734 1/20 0.32
KDM4E B2RXH2 2/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
EPHX2 P34913 1/20 0.31
TSHR P16473 2/20 0.31
NOS1 P29475 1/20 0.31

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
SCHEMBL11499232 0.89 TSHR (0.41) HDAC8ELANETSHRLMNA
SCHEMBL5172478 0.76 ALDH1A1 (0.36) ELANEMAPK1KDM4EHTT
SCHEMBL5134511 0.75 LMNA (0.46) MAPK1KDM4EHSD17B10TDP1TSHR
SCHEMBL11493283 0.72 TSHR (0.41) ELANETSHRLMNAHTT
SCHEMBL17675669 0.72 CYP19A1 (0.42) CYP3A4MAPK1KDM4ETDP1MEN1
SCHEMBL3557226 0.70 NOTUM (0.41) CYP3A4CYP2C9HSD17B10MEN1KMT2A
SCHEMBL17825837 0.69 CYP19A1 (0.59)
SCHEMBL14857936 0.69 KMT2A (0.51) TSHRMEN1KMT2ALMNA
SCHEMBL306354 0.68 CA1 (0.44) CYP3A4CYP2C9PDGFRAMAPK1MAPKAPK2
SCHEMBL14743754 0.68 NOS1 (0.39) ELANENOS1MEN1KMT2ALMNA

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230365549-A1 N-PYRIDINYL ACETAMIDE DERIVATIVES AS INHIBITORS OF THE WNT SIGNALING PATHWAY REDX PHARMA PLC (GB) 2023-11-16 US disclosed
US-11643408-B2 N-pyridinyl acetamide derivatives as inhibitors of the WNT signaling pathway REDX PHARMA PLC (GB) 2023-05-09 US disclosed
US-20210046076-A1 N-PYRIDINYL ACETAMIDE DERIVATIVES AS INHIBITORS OF THE WNT SIGNALING PATHWAY REDX PHARMA PLC (GB) 2021-02-18 US disclosed
US-10793560-B2 N-pyridinyl acetamide derivatives as inhibitors of the WNT signaling pathway REDX PHARMA PLC (GB) 2020-10-06 US disclosed
US-20180319788-A1 N-PYRIDINYL ACETAMIDE DERIVATIVES AS INHIBITORS OF THE WNT SIGNALING PATHWAY REDX PHARMA PLC (GB) 2018-11-08 US disclosed
US-20170275276-A1 N-PYRIDINYL ACETAMIDE DERIVATIVES AS INHIBITORS OF THE WNT SIGNALING PATHWAY REDX PHARMA PLC (GB) 2017-09-28 US disclosed
EP-3204378-A1 N-PYRIDINYL ACETAMIDE DERIVATIVES AS INHIBITORS OF THE WNT SIGNALLING PATHWAY Redx Pharma PLC (GB) 2017-08-16 EP disclosed
WO-2016055786-A1 N-PYRIDINYL ACETAMIDE DERIVATIVES AS INHIBITORS OF THE WNT SIGNALLING PATHWAY REDX PHARMA PLC (GB) 2016-04-14 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 (6 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-10793560-B2 N-pyridinyl acetamide derivatives as inhibitors of the WNT signaling pathway WNT1, WNT3, CTNNB1 HDAC8 1672/4885ELANE 4470/4885CYP3A4 1186/4885
US-20230365549-A1 N-PYRIDINYL ACETAMIDE DERIVATIVES AS INHIBITORS OF THE WNT SIGNALING PATHWAY WNT1, WNT3, CTNNB1 HDAC8 1643/4885ELANE 4249/4885CYP3A4 1287/4885
US-20180319788-A1 N-PYRIDINYL ACETAMIDE DERIVATIVES AS INHIBITORS OF THE WNT SIGNALING PATHWAY WNT1, WNT3, CTNNB1 HDAC8 1672/4885ELANE 4470/4885CYP3A4 1186/4885
US-20170275276-A1 N-PYRIDINYL ACETAMIDE DERIVATIVES AS INHIBITORS OF THE WNT SIGNALING PATHWAY WNT1, WNT3, CTNNB1 HDAC8 1672/4885ELANE 4470/4885CYP3A4 1186/4885
US-20210046076-A1 N-PYRIDINYL ACETAMIDE DERIVATIVES AS INHIBITORS OF THE WNT SIGNALING PATHWAY WNT1, WNT3, CTNNB1 HDAC8 1643/4885ELANE 4249/4885CYP3A4 1287/4885
US-11643408-B2 N-pyridinyl acetamide derivatives as inhibitors of the WNT signaling pathway WNT1, WNT3, CTNNB1 HDAC8 1643/4885ELANE 4249/4885CYP3A4 1287/4885

“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.