SCHEMBL20053036

SCHEMBL20053036

CCN1C(=O)N[C@H](Cc2c[nH]c3c(Cl)cccc23)C1=O

nearest known ligand 0.74

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 6/20 0.74
TNF P01375 9/20 0.71
KMT2A Q03164 3/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
MEN1 O00255 2/20 0.53
MAPT P10636 1/20 0.49
POLB P06746 1/20 0.47
LMNA P02545 1/20 0.47
PKM P14618 1/20 0.47
RIPK2 O43353 1/20 0.47

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
SCHEMBL860004 1.00 RIPK1 (0.74) RIPK1TNFKMT2AL3MBTL1MEN1
SCHEMBL9945430 0.90 RIPK1 (0.70) RIPK1TNFKMT2AL3MBTL1MEN1
SCHEMBL17399987 0.89 RIPK1 (0.72) RIPK1TNFKMT2AL3MBTL1MEN1
SCHEMBL17830374 0.86 TNF (0.82) RIPK1TNFKMT2AL3MBTL1MEN1
SCHEMBL17471693 0.86 RIPK1 (0.71) RIPK1TNFKMT2AL3MBTL1MEN1
SCHEMBL17830339 0.85 TNF (0.81) RIPK1TNFKMT2AL3MBTL1MEN1
SCHEMBL17830389 0.85 TNF (0.81) RIPK1TNFKMT2AL3MBTL1MEN1
SCHEMBL859956 0.85 RIPK1 (1.00) RIPK1TNFKMT2AL3MBTL1MEN1
SCHEMBL860317 0.85 RIPK1 (1.00) RIPK1TNFKMT2AL3MBTL1MEN1
SCHEMBL29362205 0.85 RIPK1 (1.00) RIPK1TNFKMT2AL3MBTL1MEN1

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-20190023690-A1 INHIBITORS OF CELLULAR NECROSIS AND RELATED METHODS SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY (CN) 2019-01-24 US disclosed
US-9944628-B2 Inhibitors of cellular necrosis and related methods PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2018-04-17 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-20190023690-A1 INHIBITORS OF CELLULAR NECROSIS AND RELATED METHODS LITAF, TNF, MMP8 RIPK1 198/4885TNF 2/4885KMT2A 4813/4885

“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.