SCHEMBL13072166

SCHEMBL13072166

CCC(C)OC(=O)N1CCC(N2CC[C@@H](Cc3c(Cl)cc(-c4cccc(C(F)(F)F)c4)cc3Cl)C2=O)CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
TRPV4 Q9HBA0 4/20 0.35
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
CNR1 P21554 1/20 0.35
ALDH1A1 P00352 1/20 0.35
AKR1C3 P42330 1/20 0.34
AKR1C2 P52895 1/20 0.34
GRIN2B Q13224 2/20 0.34
SMYD3 Q9H7B4 1/20 0.34
MCHR1 Q99705 2/20 0.33
NR1I2 O75469 1/20 0.33
HRH1 P35367 1/20 0.33
CCR3 P51677 1/20 0.33
TACR2 P21452 1/20 0.33
TACR3 P29371 1/20 0.33
KCNH2 Q12809 1/20 0.33

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
SCHEMBL13031203 0.88 TP53 (0.42) TP53
SCHEMBL381300 0.88 TP53 (0.42) TP53
SCHEMBL13072511 0.86 L3MBTL1 (0.37) USP2LMNAHTTALDH1A1AKR1C3
SCHEMBL13072164 0.85 TP53 (0.37) TP53USP2LMNAHTTALDH1A1
SCHEMBL380854 0.85 HRH1 (0.38) TRPV4LMNAHTTCNR1ALDH1A1
SCHEMBL13031215 0.85 HRH1 (0.38) TRPV4LMNAHTTCNR1ALDH1A1
SCHEMBL381134 0.81 CNR1 (0.36) TRPV4LMNAMAPK1CNR1GRIN2B
Trifluoroacetic Acid SCHEMBL380865 0.79 S1PR5 (0.38) CNR1GRIN2BMCHR1
SCHEMBL380663 0.79 TP53 (0.44) TP53
SCHEMBL380664 0.79 TP53 (0.44) TP53

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-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 4717/4885RXFP1 1216/4885TRPV4 4437/4885

“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.