SCHEMBL13031202

SCHEMBL13031202

CC(C)(C)OC(=O)N1CCC(N2CC[C@@H](Cc3c(Cl)cc(-c4ccccc4C(F)(F)F)cc3Cl)C2=O)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.42
EPHX2 P34913 1/20 0.42
GPR119 Q8TDV5 5/20 0.41
FPR2 P25090 1/20 0.40
KCNH2 Q12809 1/20 0.40
SCN5A Q14524 1/20 0.40
SCN9A Q15858 1/20 0.40
P2RX7 Q99572 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
STS P08842 1/20 0.37
CACNB4 O00305 1/20 0.37
CACNA1A O00555 1/20 0.37
CACNA1G O43497 1/20 0.37
CACNG3 O60359 1/20 0.37
CACNA1F O60840 1/20 0.37
CACNA1H O95180 1/20 0.37
CACNB3 P54284 1/20 0.37
CACNA2D1 P54289 1/20 0.37
CACNG7 P62955 1/20 0.37

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
SCHEMBL380467 1.00 TP53 (0.42) TP53EPHX2GPR119FPR2KCNH2
SCHEMBL13072511 0.88 L3MBTL1 (0.37) EPHX2SCN5ASCN9AP2RX7L3MBTL1
SCHEMBL381546 0.87 LMNA (0.42) EPHX2KCNH2P2RX7CACNA1C
SCHEMBL13031216 0.87 LMNA (0.42) EPHX2KCNH2P2RX7CACNA1C
SCHEMBL380664 0.86 TP53 (0.44) TP53EPHX2GPR119FPR2STS
SCHEMBL380663 0.86 TP53 (0.44) TP53EPHX2GPR119FPR2STS
SCHEMBL381300 0.85 TP53 (0.42) TP53EPHX2GPR119FPR2STS
SCHEMBL13031203 0.85 TP53 (0.42) TP53EPHX2GPR119FPR2STS
SCHEMBL381029 0.85 TP53 (0.46) TP53GPR119FPR2MEN1KMT2A
SCHEMBL381028 0.85 TP53 (0.46) TP53GPR119FPR2MEN1KMT2A

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 4717/4885EPHX2 2537/4885GPR119 46/4885

“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.