SCHEMBL381029

SCHEMBL381029

CC(C)(C)OC(=O)N1CCC(N2CCC(Cc3c(Cl)cc(-c4ccc(F)cc4)cc3Cl)C2=O)CC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.46
MMP13 P45452 1/20 0.43
FPR2 P25090 1/20 0.43
HDAC1 Q13547 3/20 0.42
HDAC2 Q92769 3/20 0.42
PTPN2 P17706 1/20 0.41
PTPN1 P18031 1/20 0.41
PTPN6 P29350 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TACR3 P29371 1/20 0.40
GPR119 Q8TDV5 7/20 0.39
STS P08842 1/20 0.38

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
SCHEMBL381028 1.00 TP53 (0.46) TP53MMP13FPR2HDAC1HDAC2
SCHEMBL380783 0.94 TP53 (0.53) TP53MMP13FPR2PTPN2PTPN1
SCHEMBL13031201 0.94 TP53 (0.53) TP53MMP13FPR2PTPN2PTPN1
SCHEMBL380664 0.92 TP53 (0.44) TP53MMP13FPR2PTPN2PTPN1
SCHEMBL380663 0.92 TP53 (0.44) TP53MMP13FPR2PTPN2PTPN1
SCHEMBL380636 0.91 GPR119 (0.51) TP53FPR2PTPN2PTPN1PTPN6
SCHEMBL380635 0.91 GPR119 (0.51) TP53FPR2PTPN2PTPN1PTPN6
SCHEMBL381061 0.91 TP53 (0.44) TP53FPR2PTPN2PTPN1PTPN6
SCHEMBL381060 0.91 TP53 (0.44) TP53FPR2PTPN2PTPN1PTPN6
SCHEMBL381752 0.90 PKM (0.39) TP53HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2049513-B1 PIPERIDINYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2012-01-25 EP disclosed
US-7829582-B2 Piperidinyl substituted pyrrolidinones as inhibitors of 11-beta-hydroxysteroid dehydrogenase 1 ELI LILLY AND COMPANY (US) 2010-11-09 US disclosed
US-20090088430-A1 PIERIDINYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY 2009-04-02 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-20090088430-A1 PIERIDINYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 HSD11B1, HSD17B1, HSD3B1 TP53 4717/4885MMP13 811/4885FPR2 3330/4885

“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.