SCHEMBL25819780

SCHEMBL25819780

CNc1ccc(C2CCON2C(=O)C2CCN(c3nccc(C#N)n3)CC2)cn1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 8/20 0.42
PANK3 Q9H999 1/20 0.39
KDM4E B2RXH2 5/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
HSD17B10 Q99714 2/20 0.35
CHRM2 P08172 1/20 0.34
CTSS P25774 2/20 0.34
TP53 P04637 1/20 0.34
EGFR P00533 1/20 0.34
CHRM4 P08173 1/20 0.34

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
SCHEMBL25296820 0.90 RIPK1 (0.45) RIPK1PANK3KDM4EALDH1A1HPGD
SCHEMBL30338609 0.90 RIPK1 (0.45) RIPK1PANK3KDM4EALDH1A1HPGD
SCHEMBL25296819 0.90 RIPK1 (0.45) RIPK1PANK3KDM4EALDH1A1HPGD
SCHEMBL25816869 0.87 RIPK1 (0.48) RIPK1PANK3KDM4ECHRM2CTSS
SCHEMBL25819773 0.86 RIPK1 (0.41) RIPK1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL25816894 0.83 RIPK1 (0.44) RIPK1PANK3KDM4EALDH1A1HPGD
SCHEMBL30339103 0.83 RIPK1 (0.44) RIPK1PANK3KDM4EALDH1A1HPGD
SCHEMBL25294928 0.82 RIPK1 (0.51) RIPK1PANK3KDM4EALDH1A1CTSS
SCHEMBL30338603 0.82 RIPK1 (0.51) RIPK1PANK3KDM4EALDH1A1CTSS
SCHEMBL25260952 0.82 RIPK1 (0.51) RIPK1PANK3KDM4EALDH1A1CTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230219937-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF SANOFI (FR) 2023-07-13 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-20230219937-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF RIPK1, RIPK4, RIPK2 RIPK1 1/4885PANK3 202/4885KDM4E 2270/4885

“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.