SCHEMBL309615

SCHEMBL309615

CC(C)(C)OC(=O)N1CCN(CCS(C)(=O)=O)CC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TLR8 Q9NR97 1/20 0.45
CHRM2 P08172 1/20 0.44
CHRM4 P08173 1/20 0.44
CHRM1 P11229 1/20 0.44
CHRM3 P20309 1/20 0.44
ACKR3 P25106 1/20 0.41
STS P08842 1/20 0.41
GPR119 Q8TDV5 6/20 0.40
HPGD P15428 1/20 0.40
EPHX2 P34913 1/20 0.40
ALDH1A1 P00352 1/20 0.39
DTYMK P23919 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
SCHEMBL21806017 0.86 USP2 (0.45) USP2SMN1; SMN2TLR8CHRM2CHRM4
SCHEMBL8242595 0.85 USP2 (0.61) USP2SMN1; SMN2TLR8CHRM2CHRM4
SCHEMBL22919673 0.82 USP2 (0.47) USP2SMN1; SMN2TLR8CHRM2CHRM4
SCHEMBL2074818 0.82 USP2 (0.44) USP2SMN1; SMN2TLR8CHRM2CHRM4
SCHEMBL20873847 0.82 USP2 (0.53) USP2SMN1; SMN2TLR8CHRM2CHRM4
SCHEMBL1901473 0.81 TLR8 (0.45) USP2SMN1; SMN2TLR8CHRM2CHRM4
SCHEMBL15273424 0.81 USP2 (0.46) USP2SMN1; SMN2TLR8CHRM2CHRM4
SCHEMBL2006368 0.81 ACKR3 (0.47) USP2SMN1; SMN2TLR8CHRM2CHRM4
SCHEMBL31457405 0.81 TLR8 (0.45) USP2SMN1; SMN2TLR8CHRM2CHRM4
SCHEMBL31457404 0.81 TLR8 (0.45) USP2SMN1; SMN2TLR8CHRM2CHRM4

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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023097189-A1 AMPK ACTIVATORS KALLYOPE, INC. (US) 2023-06-01 WO disclosed
WO-2023097187-A1 AMPK ACTIVATORS KALLYOPE, INC. (US) 2023-06-01 WO disclosed
WO-2013149362-A1 1-(DIHYDRONAPHTHALENYL)PYRIDONES AS MELANIN-CONCENTRATING HORMONE RECEPTOR 1 ANTAGONISTS GLAXOSMITHKLINE LLC (US) 2013-10-10 WO disclosed
WO-2013149362-A1 1-(DIHYDRONAPHTHALENYL)PYRIDONES AS MELANIN-CONCENTRATING HORMONE RECEPTOR 1 ANTAGONISTS GLAXOSMITHKLINE LLC (US) 2013-10-10 WO disclosed
EP-2162454-B1 IMIDAZOPYRIDINE KINASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2013-01-02 EP disclosed
EP-2162454-B1 IMIDAZOPYRIDINE KINASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2013-01-02 EP disclosed
CN-101370799-B Cis-4, 5-diaryl-2-heterocycle-imidazolines as MDM2 inhibitors HOFFMANN LA ROCHE 2012-09-05 CN disclosed
CN-1953965-B Novel cis-imidazolines HOFFMANN LA ROCHE 2012-07-04 CN disclosed
EP-2406234-A1 THIAZOLE SULFONAMIDE AND OXAZOLE SULFONAMIDE KINASE INHIBITORS GlaxoSmithKline LLC (US) 2012-01-18 EP disclosed
US-8093239-B2 Imidazopyridine kinase inhibitors GLAXOSMITHKLINE LLC (US) 2012-01-10 US disclosed
US-20070167437-A1 Cis-imidazolines FOTOUHI NADER 2007-07-19 US disclosed
CN-1953965-A Novel cis-imidazolines HOFFMANN LA ROCHE (CH) 2007-04-25 CN disclosed
EP-1758868-A1 NOVEL CIS-IMIDAZOLINES F. Hoffmann-La Roche AG (CH) 2007-03-07 EP disclosed
EP-1753727-A1 NOVEL CIS-IMIDAZOLINES F.HOFFMANN-LA ROCHE AG (CH) 2007-02-21 EP disclosed
WO-2006097261-A1 CIS-2,4,5-TRIARYL-IMIDAZOLINES AND THEIR USE AS ANTI-CANCER MEDICAMENTS F.HOFFMANN-LA ROCHE AG (CH) 2006-09-21 WO disclosed
US-20060211693-A1 Cis-imidazolines FOTOUHI NADER 2006-09-21 US disclosed
WO-2005123691-A1 NOVEL CIS-IMIDAZOLINES F-HOFFMANN-LA ROCHE AG (CH) 2005-12-29 WO disclosed
US-20050288287-A1 Chiral cis-imidazolines FOTOUHI NADER 2005-12-29 US disclosed
US-20050282803-A1 CIS-imidazolines HALEY GREGORY J 2005-12-22 US disclosed
WO-2005110996-A1 NOVEL CIS-IMIDAZOLINES F.HOFFMANN-LA ROCHE AG (CH) 2005-11-24 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 (4 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-20050282803-A1 CIS-imidazolines PPIP5K2, PIN1, CCNI USP2 4549/4885SMN1; SMN2 2154/4885TLR8 3898/4885
US-20060211693-A1 Cis-imidazolines TP53, MDM2, CDC25C USP2 1372/4885SMN1; SMN2 2851/4885TLR8 4679/4885
US-20050288287-A1 Chiral cis-imidazolines TP53, MDM2, TP53BP1 USP2 670/4885SMN1; SMN2 3320/4885TLR8 4729/4885
US-20070167437-A1 Cis-imidazolines CCNI, CCNE1, CCNA1 USP2 4325/4885SMN1; SMN2 1749/4885TLR8 4535/4885

“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.