SCHEMBL25043409

SCHEMBL25043409

Cc1nc(-c2ccc(F)cc2)c(-c2ccncc2)n1CC(=O)N1CCNCC1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RIPK3 Q9Y572 1/20 0.52
MAPK14 Q16539 15/20 0.51
ALOX5 P09917 1/20 0.45
FAAH O00519 1/20 0.45
CSNK1D P48730 1/20 0.44
MAPK13 O15264 5/20 0.43
MAPK12 P53778 5/20 0.43
MAPK11 Q15759 5/20 0.43
KDM4E B2RXH2 1/20 0.43
CYP3A4 P08684 1/20 0.43
HPGD P15428 1/20 0.43
ALOX15 P16050 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
GCGR P47871 2/20 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
SCHEMBL25044591 0.88 RIPK3 (0.52) RIPK3MAPK14CSNK1DMAPK13MAPK12
SCHEMBL30232366 0.87 RIPK3 (0.49) RIPK3MAPK14MAPK13MAPK12MAPK11
SCHEMBL30232556 0.86 RIPK3 (0.50) RIPK3MAPK14MAPK13MAPK12MAPK11
SCHEMBL28878620 0.86 MAPK14 (0.51) RIPK3MAPK14ALOX5FAAHCSNK1D
SCHEMBL23410469 0.84 GRIA1 (0.52) RIPK3MAPK14ALOX5FAAHMAPK13
SCHEMBL29974708 0.83 GRIN2B (0.42) RIPK3MAPK14FAAH
SCHEMBL23410299 0.79 MAPK14 (0.56) MAPK14CSNK1DMAPK13MAPK12MAPK11
SCHEMBL29974820 0.79 MAPK14 (0.46) RIPK3MAPK14MAPK11
SCHEMBL25044524 0.79 KCNH2 (0.43) RIPK3MAPK14MAPK13MAPK12MAPK11
SCHEMBL23410499 0.78 MAPK14 (0.53) RIPK3MAPK14ALOX5MAPK13MAPK12

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-20230052017-A1 New compounds for treatment of diseases related to DUX4 expression Facio Intellectual Property B.V. (NL) 2023-02-16 US disclosed
US-20230052017-A1 New compounds for treatment of diseases related to DUX4 expression Facio Intellectual Property B.V. (NL) 2023-02-16 US 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-20230052017-A1 New compounds for treatment of diseases related to DUX4 expression SMN1; SMN2, UTRN, DDX21 RIPK3 3338/4885MAPK14 4274/4885ALOX5 4142/4885

“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.