SCHEMBL22705446

SCHEMBL22705446

CC(C)(Oc1ccc(Cl)cc1F)C(=O)N1CCC[C@H]1c1ccc(F)cc1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 3/20 0.47
SMN1; SMN2 Q16637 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
ROCK2 O75116 2/20 0.41
CCNC P24863 5/20 0.41
CDK8 P49336 5/20 0.41
SCD O00767 2/20 0.41
HSD11B1 P28845 1/20 0.39
HSD11B2 P80365 1/20 0.39
SCD5 Q86SK9 1/20 0.39

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
SCHEMBL22688971 0.93 RIPK1 (0.44) RIPK1SMN1; SMN2L3MBTL1ROCK2CCNC
SCHEMBL22688972 0.93 RIPK1 (0.44) RIPK1SMN1; SMN2L3MBTL1ROCK2CCNC
SCHEMBL22705508 0.92 RIPK1 (0.56) RIPK1SMN1; SMN2L3MBTL1SCDHSD11B1
SCHEMBL22705380 0.92 RIPK1 (0.56) RIPK1SMN1; SMN2L3MBTL1SCDHSD11B1
SCHEMBL22705445 0.92 RIPK1 (0.50) RIPK1SMN1; SMN2L3MBTL1SCDHSD11B1
SCHEMBL22705456 0.92 L3MBTL1 (0.48) RIPK1SMN1; SMN2L3MBTL1ROCK2CCNC
SCHEMBL22705453 0.91 ROCK2 (0.43) RIPK1SMN1; SMN2L3MBTL1ROCK2CCNC
SCHEMBL22705359 0.91 SCD (0.51) RIPK1SMN1; SMN2L3MBTL1ROCK2SCD
SCHEMBL22705385 0.91 RIPK1 (0.43) RIPK1SMN1; SMN2L3MBTL1ROCK2CCNC
SCHEMBL22705379 0.91 RIPK1 (0.43) RIPK1SMN1; SMN2L3MBTL1ROCK2CCNC

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-20220213077-A1 INHIBITORS FOR PROGRAMMED CELL NECROSIS AND PREPARATION METHOD THEREFOR AND USE THEREOF SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) 2022-07-07 US disclosed
WO-2020233618-A1 INHIBITORS FOR PROGRAMMED CELL NECROSIS AND PREPARATION METHOD THEREFOR AND USE THEREOF 中国科学院上海有机化学研究所 (CN) 2020-11-26 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 (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-20220213077-A1 INHIBITORS FOR PROGRAMMED CELL NECROSIS AND PREPARATION METHOD THEREFOR AND USE THEREOF LITAF, TNF, BAD RIPK1 146/4885SMN1; SMN2 3840/4885L3MBTL1 3153/4885

“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.