SCHEMBL22454086

SCHEMBL22454086

CC(C)(C)OC(=O)N1CC(=S)NCC1(C)C

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 2/20 0.36
CTSK P43235 1/20 0.35
MAPK1 P28482 1/20 0.35
BUB1 O43683 1/20 0.32
USP2 O75604 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CHRM2 P08172 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
ESR2 Q92731 1/20 0.30
GRIN2B Q13224 1/20 0.30
GRIN2C Q14957 1/20 0.30

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
SCHEMBL12017166 0.83 NR1H2 (0.36) NR1H2CTSKMAPK1BUB1USP2
SCHEMBL22445794 0.77
SCHEMBL27121464 0.75 DDB1 (0.39) NR1H2CTSKMAPK1BUB1USP2
SCHEMBL21244820 0.71 BUB1 (0.40) NR1H2CTSKMAPK1BUB1USP2
SCHEMBL26884952 0.70 USP2 (0.42) NR1H2CTSKBUB1USP2SMN1; SMN2
SCHEMBL17536013 0.70 CHRM2 (0.39) NR1H2MAPK1BUB1USP2SMN1; SMN2
SCHEMBL324691 0.70 USP2 (0.38) NR1H2CTSKMAPK1BUB1USP2
SCHEMBL22445776 0.70 MAPK1 (0.40) NR1H2CTSKMAPK1BUB1USP2
SCHEMBL3524396 0.69 MAPK1 (0.58) NR1H2MAPK1USP2SMN1; SMN2KDM4E
SCHEMBL21598808 0.69 DDB1 (0.38) NR1H2CTSKBUB1USP2SMN1; SMN2

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-20220162192-A1 INDAZOLES AS LRRK2 INHIBITORS ESCAPE Bio, Inc. 2022-05-26 US disclosed
WO-2020191261-A1 INDAZOLES AS LRRK2 INHIBITORS E-SCAPE BIO, INC. (US) 2020-09-24 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-20220162192-A1 INDAZOLES AS LRRK2 INHIBITORS LRRK2, PARK7, PINK1 NR1H2 2464/4885CTSK 1746/4885MAPK1 875/4885

“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.